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Details

Stereochemistry RACEMIC
Molecular Formula C7H13N
Molecular Weight 111.1848
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,4-DIMETHYLPENTANENITRILE

SMILES

CC(C)CC(C)C#N

InChI

InChIKey=COXCGWKSEPPDAA-UHFFFAOYSA-N
InChI=1S/C7H13N/c1-6(2)4-7(3)5-8/h6-7H,4H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C7H13N
Molecular Weight 111.1848
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:25:39 GMT 2023
Edited
by admin
on Sat Dec 16 10:25:39 GMT 2023
Record UNII
H57Z2TS56Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,4-DIMETHYLPENTANENITRILE
Systematic Name English
2,4-DIMETHYLVALERONITRILE
Systematic Name English
PENTANENITRILE, 2,4-DIMETHYL-
Systematic Name English
Code System Code Type Description
FDA UNII
H57Z2TS56Q
Created by admin on Sat Dec 16 10:25:39 GMT 2023 , Edited by admin on Sat Dec 16 10:25:39 GMT 2023
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CAS
69975-94-6
Created by admin on Sat Dec 16 10:25:39 GMT 2023 , Edited by admin on Sat Dec 16 10:25:39 GMT 2023
PRIMARY
PUBCHEM
21881676
Created by admin on Sat Dec 16 10:25:39 GMT 2023 , Edited by admin on Sat Dec 16 10:25:39 GMT 2023
PRIMARY
EPA CompTox
DTXSID40619337
Created by admin on Sat Dec 16 10:25:39 GMT 2023 , Edited by admin on Sat Dec 16 10:25:39 GMT 2023
PRIMARY