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Details

Stereochemistry ACHIRAL
Molecular Formula C8H14N2
Molecular Weight 138.2102
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HEXAHYDRO-1H-AZEPINE-1-ACETONITRILE

SMILES

N#CCN1CCCCCC1

InChI

InChIKey=OHKGIEVCPHMZKY-UHFFFAOYSA-N
InChI=1S/C8H14N2/c9-5-8-10-6-3-1-2-4-7-10/h1-4,6-8H2

HIDE SMILES / InChI

Molecular Formula C8H14N2
Molecular Weight 138.2102
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 Sat Dec 16 12:35:55 GMT 2023
Edited
by admin
on Sat Dec 16 12:35:55 GMT 2023
Record UNII
BF3UXM6BK7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HEXAHYDRO-1H-AZEPINE-1-ACETONITRILE
Systematic Name English
NSC-74468
Code English
HEXAMETHYLENEIMINOACETONITRILE
Systematic Name English
1H-AZEPINE-1-ACETONITRILE, HEXAHYDRO-
Systematic Name English
(1-AZEPANYL)ACETONITRILE
Systematic Name English
Code System Code Type Description
CAS
54714-50-0
Created by admin on Sat Dec 16 12:35:55 GMT 2023 , Edited by admin on Sat Dec 16 12:35:55 GMT 2023
PRIMARY
EPA CompTox
DTXSID30203183
Created by admin on Sat Dec 16 12:35:55 GMT 2023 , Edited by admin on Sat Dec 16 12:35:55 GMT 2023
PRIMARY
PUBCHEM
41164
Created by admin on Sat Dec 16 12:35:55 GMT 2023 , Edited by admin on Sat Dec 16 12:35:55 GMT 2023
PRIMARY
FDA UNII
BF3UXM6BK7
Created by admin on Sat Dec 16 12:35:55 GMT 2023 , Edited by admin on Sat Dec 16 12:35:55 GMT 2023
PRIMARY
ECHA (EC/EINECS)
259-302-8
Created by admin on Sat Dec 16 12:35:55 GMT 2023 , Edited by admin on Sat Dec 16 12:35:55 GMT 2023
PRIMARY
NSC
74468
Created by admin on Sat Dec 16 12:35:55 GMT 2023 , Edited by admin on Sat Dec 16 12:35:55 GMT 2023
PRIMARY