(Q407768)

Gene Ontology release 2019-11-16

chemical structure

Chlorobenzene2.svg
512 × 853; 2 KB

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mass

112.008 dalton

1 reference

CHLOROBENZENE (English)

19 October 2016

has effect

chlorobenzene exposure

1 reference

chemical formula

C₆H₅Cl

1 reference

CHLOROBENZENE (English)

19 October 2016

canonical SMILES

C1=CC=C(C=C1)Cl

1 reference

CHLOROBENZENE (English)

19 October 2016

ionization energy

9.07±0.01 electronvolt

series ordinal

1

1 reference

9.06 electronvolt

series ordinal

1

1 reference

Basic laboratory and industrial chemicals: A CRC quick reference handbook

electric dipole moment

1.69 debye

1 reference

Basic laboratory and industrial chemicals: A CRC quick reference handbook

density

1.11±0.01 gram per cubic centimetre

temperature

20±1 degree Celsius

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melting point

−50±1 degree Fahrenheit

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−45.0 degree Celsius

1 reference

Jean-Claude Bradley Open Melting Point Dataset

−45.2 degree Celsius

1 reference

Basic laboratory and industrial chemicals: A CRC quick reference handbook

boiling point

270±1 degree Fahrenheit

under pressure

760±1 torr

1 reference

131.72 degree Celsius

under pressure

101.325 kilopascal

1 reference

Basic laboratory and industrial chemicals: A CRC quick reference handbook

vapor pressure

9±1 millimetre of mercury

temperature

68±1 degree Fahrenheit

1 reference

CRC Handbook of Chemistry and Physics (78th edition)

speed of sound

1,311±1 metre per second

20±1 degree Celsius

1 reference

page(s)

14-37

solubility

0.05±0.01 gram per 100 gram of solvent

temperature

68±1 degree Fahrenheit

solvent

water

1 reference

Pensky–Martens closed-cup test

flash point

82±1 degree Fahrenheit

determination method

1 reference

lower flammable limit

1.3±0.1 volume percent

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upper flammable limit

9.6±0.1 volume percent

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safety classification and labelling

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

2

3

0

no value

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no-observed-adverse-effect level

English Wikipedia

NIOSH Pocket Guide ID

0121

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27.25 milligram per kilogram

applies to taxon

dog

route of administration

oral administration

duration

13 week

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time-weighted average exposure limit

350±1 milligram per cubic metre

applies to jurisdiction

United States of America

duration

8±1 hour

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immediately dangerous to life or health

4,610±10 milligram per cubic metre

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Class IC flammable liquid

has characteristic

1 reference

MCN code

2903.91.10

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Chlorobenzene

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Identifiers

GND ID

4268618-0

1 reference

InChI=1S/C6H5Cl/c7-6-4-2-1-3-5-6/h1-5H

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chlorbenzen

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InChI

1 reference

CHLOROBENZENE (English)

MVPPADPHJFYWMZ-UHFFFAOYSA-N

19 October 2016

InChIKey

2 references

CHLOROBENZENE (English)

19 October 2016

ChEBI release 2020-09-01

2 references

chlorobenzene (English)

MVPPADPHJFYWMZ-UHFFFAOYSA-N

19 October 2016

InChIKey

8 April 2021

https://commonchemistry.cas.org/detail?cas_rn=108-90-7

1 reference

Chlorobenzene (English)

19 October 2016

1 reference

CHLOROBENZENE (English)

19 October 2016

Reaxys registry number

605632

1 reference

chlorobenzene (English)

19 October 2016

Gmelin number

26704

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ChEBI ID

28097

mapping relation type

1 reference

chlorobenzene (English)

19 October 2016

1 reference

MSBNK-Fac_Eng_Univ_Tokyo-JP000949

CHLOROBENZENE (English)

19 October 2016

1 reference

MassBank accession ID

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MSBNK-Fac_Eng_Univ_Tokyo-JP010450

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MSBNK-Fac_Eng_Univ_Tokyo-JP003628

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SPLASH

splash10-03di-5900000000-0c50f1cf42286eb0397e

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splash10-03di-9500000000-12a9a9ae9833f5dbfa91

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splash10-03di-6900000000-2d1780378a9603646722

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splash10-03di-8900000000-19a5dcfc05cbaaa94766

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CZ0175000

1 reference

Spanish Wikipedia

ZVG number

11950

1 reference

Hazardous Substances Data Bank

1 reference

28 October 2019

CHLOROBENZENE (English)

10 May 2021

1 reference

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

DSSTOX compound identifier

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203-628-5

1 reference

Global Substance Registration System

UNII

K18102WN1G

chlorobenzene (English)

ECHA Substance Infocard ID

19 October 2016

100.003.299

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.003.299

27 December 2018

PesticideInfo chemical ID

Chlorobenzene (English)

quotation

CAS no.: 108-90-7 (English)

PRI2021

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UM-BBD compound ID

c0105

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AICS Chemical ID (BEING DELETED)

2812

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Human Metabolome Database ID

0 references

1 reference

Global Substance Registration System

UNII

K18102WN1G

chlorobenzene (English)

19 October 2016

KEGG ID

C06990

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Encyclopædia Britannica Online ID

English Wikipedia

PDB ligand ID

8CL

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science/chlorobenzene

subject named as

chlorobenzene

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Encyclopedia of China (Third Edition) ID

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1 reference

28 October 2013

Great Russian Encyclopedia Online ID (old version)

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0 references

1 reference

9 July 2020

Microsoft Academic ID

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1 reference

26 January 2022

https://docs.openalex.org/download-snapshot/snapshot-data-format

1 reference

3G4W (English)

19 October 2016

1 reference

1 reference

German Wikipedia

Store norske leksikon ID

klorbenzen

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WordNet 3.1 Synset ID

14627414-n

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