(Q27269300)

2-Hexylthiophene (English)

14 October 2016

chemical formula

C₁₀H₁₆S

1 reference

2-Hexylthiophene (English)

14 October 2016

canonical SMILES

CCCCCCC1=CC=CS1

1 reference

Constituents of essential oil from the dried fruits and stems of Akebia quinata (THUNB.) DECNE.

2-Hexylthiophene (English)

14 October 2016

1 reference

Identifiers

InChI

InChI=1S/C10H16S/c1-2-3-4-5-7-10-8-6-9-11-10/h6,8-9H,2-5,7H2,1H3

1 reference

2-Hexylthiophene (English)

14 October 2016

1 reference

Global Substance Registration System

2-Hexylthiophene (English)

14 October 2016

2 references

2-hexylthiophene (English)

14 October 2016

https://commonchemistry.cas.org/detail?cas_rn=18794-77-9

10 April 2021

1 reference

2-Hexylthiophene (English)

14 October 2016

1 reference

2-Hexylthiophene (English)

14 October 2016

ChEBI ID

168978

mapping relation type

exact match

2 references

ChEBI release 2022-06-13

International Chemical Identifier

InChI

InChI=1S/C10H16S/c1-2-3-4-5-7-10-8-6-9-11-10/h6,8-9H,2-5,7H2,1H3

SureChEMBL ID

SCHEMBL28940

2 references

based on heuristic

inferred from InChIKey

MSBNK-Fac_Eng_Univ_Tokyo-JP007777

1 reference

MassBank accession ID

0 references

SPLASH

splash10-0002-9200000000-d7124f84ce2fcff5ade0

0 references

DSSTox substance ID

DTXSID50172120

2 references

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

DSSTOX compound identifier

DTXCID4094611

0 references

EC number

242-579-4

1 reference

Global Substance Registration System

2-hexylthiophene (English)

ECHA Substance Infocard ID

14 October 2016

100.038.693

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.038.693

27 December 2018

AICS Chemical ID (BEING DELETED)

2-hexylthiophene (English)

quotation

CAS no.: 18794-77-9 (English)

FL number

15.076

1 reference

quotation

CAS no.: 18794-77-9 (English)

23 January 2021

15.076

14942

0 references

Human Metabolome Database ID

HMDB0032329

2 references

based on heuristic

inferred from InChIKey

2 references

Global Substance Registration System

2-hexylthiophene (English)

14 October 2016

Probes And Drugs ID

PD157941

0 references

JECFA number

1764

1 reference

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