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Details

Stereochemistry ACHIRAL
Molecular Formula C3H3N
Molecular Weight 53.0626
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACRYLONITRILE

SMILES

C=CC#N

InChI

InChIKey=NLHHRLWOUZZQLW-UHFFFAOYSA-N
InChI=1S/C3H3N/c1-2-3-4/h2H,1H2

HIDE SMILES / InChI

Molecular Formula C3H3N
Molecular Weight 53.0626
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 17:18:23 UTC 2023
Edited
by admin
on Fri Dec 15 17:18:23 UTC 2023
Record UNII
MP1U0D42PE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACRYLONITRILE
HSDB   MI  
Systematic Name English
ACRYLONITRILE [MI]
Common Name English
NSC-6362
Code English
VCN
Common Name English
VENTOX
Brand Name English
CYANOETHYLENE
Systematic Name English
PROPENENITRILE
Systematic Name English
ACRYLONITRILE [INCI]
Common Name English
ACRYLONITRILE [IARC]
Common Name English
2-PROPENENITRILE
Systematic Name English
FUMIGRAIN
Brand Name English
ACRYLONITRILE [HSDB]
Common Name English
VINYL CYANIDE
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C45176
Created by admin on Fri Dec 15 17:18:23 UTC 2023 , Edited by admin on Fri Dec 15 17:18:23 UTC 2023
EPA PESTICIDE CODE 601
Created by admin on Fri Dec 15 17:18:23 UTC 2023 , Edited by admin on Fri Dec 15 17:18:23 UTC 2023
Code System Code Type Description
NCI_THESAURUS
C28130
Created by admin on Fri Dec 15 17:18:23 UTC 2023 , Edited by admin on Fri Dec 15 17:18:23 UTC 2023
PRIMARY
CHEBI
28217
Created by admin on Fri Dec 15 17:18:23 UTC 2023 , Edited by admin on Fri Dec 15 17:18:23 UTC 2023
PRIMARY
PUBCHEM
7855
Created by admin on Fri Dec 15 17:18:23 UTC 2023 , Edited by admin on Fri Dec 15 17:18:23 UTC 2023
PRIMARY
WIKIPEDIA
ACRYLONITRILE
Created by admin on Fri Dec 15 17:18:23 UTC 2023 , Edited by admin on Fri Dec 15 17:18:23 UTC 2023
PRIMARY
ALANWOOD
acrylonitrile
Created by admin on Fri Dec 15 17:18:23 UTC 2023 , Edited by admin on Fri Dec 15 17:18:23 UTC 2023
PRIMARY
HSDB
176
Created by admin on Fri Dec 15 17:18:23 UTC 2023 , Edited by admin on Fri Dec 15 17:18:23 UTC 2023
PRIMARY
NSC
6362
Created by admin on Fri Dec 15 17:18:23 UTC 2023 , Edited by admin on Fri Dec 15 17:18:23 UTC 2023
PRIMARY
ECHA (EC/EINECS)
203-466-5
Created by admin on Fri Dec 15 17:18:23 UTC 2023 , Edited by admin on Fri Dec 15 17:18:23 UTC 2023
PRIMARY
EPA CompTox
DTXSID5020029
Created by admin on Fri Dec 15 17:18:23 UTC 2023 , Edited by admin on Fri Dec 15 17:18:23 UTC 2023
PRIMARY
CAS
107-13-1
Created by admin on Fri Dec 15 17:18:23 UTC 2023 , Edited by admin on Fri Dec 15 17:18:23 UTC 2023
PRIMARY
MESH
D000181
Created by admin on Fri Dec 15 17:18:23 UTC 2023 , Edited by admin on Fri Dec 15 17:18:23 UTC 2023
PRIMARY
DAILYMED
MP1U0D42PE
Created by admin on Fri Dec 15 17:18:23 UTC 2023 , Edited by admin on Fri Dec 15 17:18:23 UTC 2023
PRIMARY
FDA UNII
MP1U0D42PE
Created by admin on Fri Dec 15 17:18:23 UTC 2023 , Edited by admin on Fri Dec 15 17:18:23 UTC 2023
PRIMARY
MERCK INDEX
m1392
Created by admin on Fri Dec 15 17:18:23 UTC 2023 , Edited by admin on Fri Dec 15 17:18:23 UTC 2023
PRIMARY Merck Index
EVMPD
SUB33091
Created by admin on Fri Dec 15 17:18:23 UTC 2023 , Edited by admin on Fri Dec 15 17:18:23 UTC 2023
PRIMARY
Related Record Type Details
METABOLITE -> PARENT
URINE
METABOLITE -> PARENT