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Details

Stereochemistry ACHIRAL
Molecular Formula C5H9N
Molecular Weight 83.1317
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VALERONITRILE

SMILES

CCCCC#N

InChI

InChIKey=RFFFKMOABOFIDF-UHFFFAOYSA-N
InChI=1S/C5H9N/c1-2-3-4-5-6/h2-4H2,1H3

HIDE SMILES / InChI

Molecular Formula C5H9N
Molecular Weight 83.1317
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 17:10:34 UTC 2023
Edited
by admin
on Fri Dec 15 17:10:34 UTC 2023
Record UNII
X44H3R47D4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VALERONITRILE
MI  
Systematic Name English
VALERONITRILE [MI]
Common Name English
1-BUTYL CYANIDE
Systematic Name English
VALPROIC ACID IMPURITY H [EP IMPURITY]
Common Name English
1-CYANOBUTANE
Systematic Name English
N-BUTYL CYANIDE
Systematic Name English
PENTANENITRILE
Systematic Name English
Code System Code Type Description
PUBCHEM
8061
Created by admin on Fri Dec 15 17:10:34 UTC 2023 , Edited by admin on Fri Dec 15 17:10:34 UTC 2023
PRIMARY
MERCK INDEX
m11361
Created by admin on Fri Dec 15 17:10:34 UTC 2023 , Edited by admin on Fri Dec 15 17:10:34 UTC 2023
PRIMARY Merck Index
FDA UNII
X44H3R47D4
Created by admin on Fri Dec 15 17:10:34 UTC 2023 , Edited by admin on Fri Dec 15 17:10:34 UTC 2023
PRIMARY
CAS
110-59-8
Created by admin on Fri Dec 15 17:10:34 UTC 2023 , Edited by admin on Fri Dec 15 17:10:34 UTC 2023
PRIMARY
EPA CompTox
DTXSID3026275
Created by admin on Fri Dec 15 17:10:34 UTC 2023 , Edited by admin on Fri Dec 15 17:10:34 UTC 2023
PRIMARY
WIKIPEDIA
Pentanenitrile
Created by admin on Fri Dec 15 17:10:34 UTC 2023 , Edited by admin on Fri Dec 15 17:10:34 UTC 2023
PRIMARY
ECHA (EC/EINECS)
203-781-8
Created by admin on Fri Dec 15 17:10:34 UTC 2023 , Edited by admin on Fri Dec 15 17:10:34 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
UNSPECIFIED
CHROMATOGRAPHIC PURITY (GC)
EP