(Q161632)

Gene Ontology release 2020-05-02

Rhea release 113

chemical structure

Hexadecan-1-ol Skelett.svg
618 × 45; 4 KB

1 reference

image of molecular model or crystal lattice model

German Wikipedia

Cetyl alcohol.png
948 × 608; 71 KB

1 reference

https://ru.wikipedia.org/?oldid=105858063

Russian Wikipedia

Wikimedia import URL

mass

242.261 dalton

1 reference

1-Hexadecanol (English)

17 November 2016

chemical formula

C₁₆H₃₄O

1 reference

1-Hexadecanol (English)

17 November 2016

canonical SMILES

CCCCCCCCCCCCCCCCO

1 reference

1-Hexadecanol (English)

CRC Handbook of Chemistry and Physics (97th edition)

17 November 2016

density

0.8187 gram per cubic centimetre

50 degree Celsius

1 reference

3-294

0.84 gram per cubic centimetre

20 degree Celsius

1 reference

10 March 2020

49.0 degree Celsius

1 reference

Jean-Claude Bradley Open Melting Point Dataset

49.3±0.01 degree Celsius

reason for preferred rank

most precise value

uncertainty corresponds to

expanded uncertainty

1 reference

CRC Handbook of Chemistry and Physics (97th edition)

uncertainty corresponds to

3-294

boiling point

325±2 degree Celsius

under pressure

101.325 kilopascal

expanded uncertainty

1 reference

CRC Handbook of Chemistry and Physics (97th edition)

3-294

344 degree Celsius

under pressure

unknown value

1 reference

10 March 2020

334 degree Celsius

under pressure

101.325 kilopascal

1 reference

Basic laboratory and industrial chemicals: A CRC quick reference handbook

770±8 kelvin

1.47±10 megapascal

1,059±23 cubic centimetre per mole

uncertainty corresponds to

expanded uncertainty

1 reference

CRC Handbook of Chemistry and Physics (97th edition)

CRC Handbook of Chemistry and Physics (97th edition)

6-74

dynamic viscosity

8.0 millipascal second

60 degree Celsius

unknown value

1 reference

10 March 2020

0.00003 gram per kilogram of solvent

25 degree Celsius

1 reference

5-153

unknown value

unknown value

acetone

soluble

1 reference

CRC Handbook of Chemistry and Physics (97th edition)

3-294

unknown value

unknown value

diethyl ether

very soluble

1 reference

CRC Handbook of Chemistry and Physics (97th edition)

3-294

unknown value

unknown value

benzene

very soluble

1 reference

CRC Handbook of Chemistry and Physics (97th edition)

3-294

unknown value

unknown value

chloroform

very soluble

1 reference

CRC Handbook of Chemistry and Physics (97th edition)

3-294

unknown value

unknown value

ethanol

slightly soluble

1 reference

CRC Handbook of Chemistry and Physics (97th edition)

3-294

1.4283

79 degree Celsius

589 nanometre

1 reference

CRC Handbook of Chemistry and Physics (97th edition)

Pensky–Martens closed-cup test

3-294

flash point

155 degree Celsius

determination method

sourcing circumstances

1 reference

10 March 2020

autoignition temperature

245 degree Celsius

1 reference

10 March 2020

safety classification and labelling

NFPA 704: Standard System for the Identification of the Hazards of Materials for Emergency Response

1

1

0

no value

1 reference

Regulation (EC) No. 1272/2008

English Wikipedia

GHS hazard pictogram

no value

GHS signal word

no value

GHS hazard statement

no value

GHS precautionary statement

no value

1 reference

10 March 2020

2017

median lethal dose (LD50)

5 gram per kilogram

route of administration

1 reference

10 March 2020

1 reference

The chemical composition of the surface wax of lolium perenne

Gibberella fujikuroi

1 reference

Fusarin C and 8Z-fusarin C from Gibberella fujikuroi

Fusarium fujikuroi

1 reference

Fusarin C and 8Z-fusarin C from Gibberella fujikuroi

Pelargonium endlicherianum

1 reference

The analysis of essential oil and headspace volatiles of the flowers of Pelargonium endlicherianum used as an anthelmintic in folk medicine

Hamamelis virginiana

1 reference

Study on the composition of the volatile fraction of Hamamelis virginiana

Helichrysum ambiguum

1 reference

Composition and antibacterial activity of the essential oils of Helichrysum rupestre and H. ambiguum growing in the Balearic Islands (Part III)

Mikania congesta

1 reference

Mikania banisteriae

1 reference

Angelica archangelica

1 reference

Extraction of Volatile Compounds of Angelica (Angelica archangelica L.) Root by Liquid Carbon Dioxide

Camponotus vagus

1 reference

Hexadecanol and hexadecyl formate in the venom gland of formicine ants

Formica polyctena

1 reference

Hexadecanol and hexadecyl formate in the venom gland of formicine ants

black garden ant

1 reference

Hexadecanol and hexadecyl formate in the venom gland of formicine ants

Polyrhachis gagates

1 reference

Hexadecanol and hexadecyl formate in the venom gland of formicine ants

Cichorium endivia

1 reference

Neutral volatiles from blended endive (Cichorium endivia, L.)

Launaea resedifolia

1 reference

Chemical composition and antibacterial activity of the essential oils from Launaea resedifolia L

Entodon luridus

2 references

[Studies on chemical constituents of Isodon excisoides].

A new triterpenoid from Entodon okamurae Broth

Chlamydomonas reinhardtii

1 reference

The response of Chlamydomonas reinhardtii to nitrogen deprivation: a systems biology analysis

Angelica gigas

2 references

Bioactivity-guided fractionation and GC/MS fingerprinting of Angelica sinensis and Angelica archangelica root components for antifungal and mosquito deterrent activity.

Volatile organic compounds of Angelica gigas Nakai, Korean medicinal herb

Eucalyptus globulus

1 reference

The composition of Eucalyptus and some other leaf waxes

Hemileuca electra

1 reference

Geographic Variation in the Pheromone System of the Saturniid Moth Hemileuca eglanterina

Ipomoea orizabensis

1 reference

I.—Chemical examination of the root of ipomoea orizabensis

Mikania campanulata

1 reference

C-15-functionalized eudesmanolides from Mikania campanulata

Velella velella

1 reference

Über die chemische Zusammensetzung der Qualle Velella spirans.

Anoplolepis custodiens

1 reference

Hexadecanol and hexadecyl formate in the venom gland of formicine ants

Sarcophyton infundibuliforme

1 reference

Sarcoglycosides A - C, NewO-Glycosylglycerol Derivatives from the South China Sea Soft CoralSarcophyton infundibuliforme

Cannabis sativa

1 reference

Constituents of Cannabis sativa L. XVII. A review of the natural constituents

Mangifera indica

1 reference

Aroma Volatile Constituents of Brazilian Varieties of Mango Fruit

Matricaria chamomilla

1 reference

Propagation Method and Distillation Apparatus Type Affect Essential Oil from Different Parts of Matricaria recutita L. Plants

Chamomilla recutita

1 reference

Propagation Method and Distillation Apparatus Type Affect Essential Oil from Different Parts of Matricaria recutita L. Plants

Durio zibethinus

1 reference

Sulfur-Containing Volatiles of Durian Fruits (Durio zibethinus Murr.)

Murraya paniculata

1 reference

Essential oil composition ofMurraya exotica from the plains of northern India

tomato

1 reference

Isolation and identification of secondary metabolites from hexane extract of culture filtrate of Bacillus licheniformis MTCC 7445

Camellia sinensis

1 reference

Metabolite profiling of Camellia sinensis by automated sequential, multidimensional gas chromatography/mass spectrometry reveals strong monsoon effects on tea constituents

Mikania parviflora

1 reference

Mikania cordifolia

1 reference

Atalantia buxifolia

1 reference

The Leaf Oils ofSeverinia buxifolia(Poir.) Tenore.

Persicaria minor

1 reference

Volatile profiling of aromatic traditional medicinal plant, Polygonum minus in different tissues and its biological activities.

Athanasia linifolia

2 references

Sesquiterpene and long chain ester from Tanacetum longifolium

Sesquiterpene and Long Chain Ester from Tanacetum longifolium.

Chrysocephalum ambiguum

1 reference

Composition and antibacterial activity of the essential oils of Helichrysum rupestre and H. ambiguum growing in the Balearic Islands (Part III)

Persicaria hydropiperoides

1 reference

Volatile profiling of aromatic traditional medicinal plant, Polygonum minus in different tissues and its biological activities.

Homo sapiens

1 reference

Global gas chromatography/time-of-flight mass spectrometry (GC/TOFMS)-based metabonomic profiling of lyophilized human feces

1 reference

https://reactome.org/PathwayBrowser/#/R-HSA-1430728&DTAB=MT

MCN code

2905.17.20

0 references

0 references

0 references

Cetyl alcohol

0 references

catalog

CAS COVID-19 Anti-Viral Candidate Compounds

0 references

Identifiers

InChI

InChI=1S/C16H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h17H,2-16H2,1H3

1 reference

1-Hexadecanol (English)

BXWNKGSJHAJOGX-UHFFFAOYSA-N

17 November 2016

InChIKey

2 references

1-Hexadecanol (English)

17 November 2016

ChEBI release 2020-09-01

CAS Registry Number

36653-82-4

2 references

cetyl alcohol (English)

BXWNKGSJHAJOGX-UHFFFAOYSA-N

17 November 2016

InChIKey

10 April 2021

https://commonchemistry.cas.org/detail?cas_rn=36653-82-4

1 reference

Hexadecan-1-ol (English)

17 November 2016

1 reference

1-Hexadecanol (English)

17 November 2016

Reaxys registry number

1748475

1 reference

hexadecan-1-ol (English)

19 October 2016

ChEBI ID

16125

mapping relation type

1 reference

CETYL ALCOHOL (English)

17 November 2016

1 reference

Biological Magnetic Resonance Data Bank

CETYL ALCOHOL (English)

17 November 2016

1 reference

1 reference

BMRB ID

bmse000487

MSBNK-Osaka_Univ-OUF00006

MassBank accession ID

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP006869

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP007706

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP008108

0 references

SPLASH

splash10-0a4l-9000000000-83f0c3f9a7d1a2d70b83

0 references

splash10-0a59-9100000000-51d2315e018d6ebbe25d

0 references

splash10-0f72-7931000000-00a8faa3fd4f0c38a405

0 references

splash10-0f72-9821000000-ee82a405e4a854526b64

0 references

splash10-0f6t-9531000000-0dc2948d10d835886750

0 references

splash10-0udi-0900000000-7aab213ad736e774476c

0 references

splash10-0udi-0910000000-b74545433556690d2c46

0 references

splash10-0udi-0900000000-55a8272e13510c85c06a

0 references

splash10-0a5c-9000000000-f3299e52ea0593788e37

0 references

RTECS number

MM0225000

1 reference

French Wikipedia

ZVG number

24650

1 reference

Hazardous Substances Data Bank

1 reference

28 October 2019

1-HEXADECANOL (English)

10 May 2021

1 reference

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

DSSTOX compound identifier

0 references

0 references

253-149-0

1 reference

cetyl alcohol (English)

ECHA Substance Infocard ID

17 November 2016

100.048.301

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.048.301

27 December 2018

PesticideInfo chemical ID

Hexadecan-1-ol (English)

quotation

CAS no.: 36653-82-4 (English)

FL number

02.009

1 reference

quotation

CAS no.: 36653-82-4 (English)

23 January 2021

02.009

1 reference

28 December 2019

CETYL ALCOHOL (English)

quotation

CAS no.: 36653-82-4 (English)

0 references

1 reference

AICS Chemical ID (BEING DELETED)

0 references

1 reference

cetyl alcohol (English)

17 November 2016

1 reference

Human Metabolome Database ID

Cetyl alcohol (English)

publication date

3 July 2018

HMDB0003424

1 reference

based on heuristic

inferred from InChIKey

KNApSAcK ID

C00052572

1 reference

based on heuristic

inferred from InChIKey

1 reference

cetyl alcohol (English)

17 November 2016

1 reference

cetyl alcohol (English)

17 November 2016

0 references

1 reference

1 reference

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

hexadecan-1-ol (English)

19 October 2016

0 references

1 reference

30 June 2018

1 reference

https://www.swisslipids.org/#/downloads

6 November 2021

0 references

1 reference

6 April 2020

0 references

Encyclopædia Britannica Online ID

science/cetyl-alcohol

subject named as

cetyl alcohol

0 references

1 reference

28 October 2013

0 references

114

1 reference

Evaluations of the Joint FAO/WHO Expert Committee on Food Additives (JECFA)

13 May 2021

Microsoft Academic ID

0 references

1 reference

4RC7 (English)

19 October 2016

1 reference

2UUU (English)

19 October 2016

1 reference

2UUV (English)

19 October 2016

1 reference

4RC5 (English)

19 October 2016

1 reference

4QUW (English)

19 October 2016

Store norske leksikon ID

0 references

1 reference

cetyl alcohol (English)