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N-(2-Cyano-1-cyclopenten-1-yl)-acetamide

HCID 817014
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Basic information

CAS
100377-16-0
Standard SMILES
CC(=O)NC1=C(C#N)CCC1
InChIKey
LCPRDSCJGSKDRE-UHFFFAOYSA-N
Molecular formula
C8H10N2O
Average molar mass
150.18 g/mol
Monoisotopic mass
150.07931295

Names & identifiers

Preferred name
N-(2-Cyano-1-cyclopenten-1-yl)-acetamide
IUPAC
N-(2-cyanocyclopenten-1-yl)acetamide
English name
N-(2-Cyano-1-cyclopenten-1-yl)-acetamide
Molecular formula
C8H10N2O
Molecular weight
150.18

Names & synonyms

100377-16-0N-(2-Cyano-1-cyclopenten-1-yl)-acetamideN-(2-cyanocyclopent-1-en-1-yl)acetamideN-(2-cyanocyclopenten-1-yl)acetamideMFCD01020954N-(2-cyanocyclopent-1-enyl)acetamideN-(2-Cyano-cyclopent-1-enyl)-acetamideSCHEMBL15545246DTXSID80355727SBB086714AKOS006241620AC-5608
Show more names
Acetamide, N-(2-cyano-1-cyclopenten-1-yl)-2-acetylamino-1-cyclopentene-1-carbonitrileAcetamide, N-(2-cyano-1-cyclopenten-1-yl)- (6CI, 9CI)
NCGC00186303-01NCGC00186303-02NCGC00186303-03NCGC00186303-04NCGC00186303-05NCGC00186303-06NCGC00186303-07NCGC00186303-08

Database identifiers

CAS
100377-16-0
PubChem CID
817014
DTXSID
DTXSID80355727
Nikkaji
J2.961.424E

Properties

Computed structural properties

XLogP
0.6
Topological polar surface area
52.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
11
Formal charge
0
Complexity
257

Physicochemical properties

Boiling point
354 °C · 354°C
Density
1.11 · 1.11
Flash point
168 °C · 168°C
HS Code
2926907090 · 2926907090

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

hs_code
2926907090

Chemistry & industry

Applications

Usesn-(2-cyano-cyclopent-1-enyl)-acetamide is a useful chemical for the hydrogenation of β-acetylaminoacrylonitriles.

Related reactions

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Compound notes

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