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N-(3-nitrophenyl)-1-phenylcyclopentane-1-carboxamide

HCID 178917443
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Basic information

CAS
328964-80-3
Standard SMILES
O=C(Nc1cccc([N+](=O)[O-])c1)C1(c2ccccc2)CCCC1
InChIKey
CUYOQKLJDVXHHJ-UHFFFAOYSA-N
Molecular formula
C18H18N2O3
Average molar mass
310.3 g/mol

Names & identifiers

Preferred name
N-(3-nitrophenyl)-1-phenylcyclopentane-1-carboxamide
IUPAC
N-(3-nitrophenyl)-1-phenylcyclopentane-1-carboxamide
English name
N-(3-Nitrophenyl)(phenylcyclopentyl)formamide
Molecular formula
C18H18N2O3
Molecular weight
310.35

Names & synonyms

328964-80-3N-(3-nitrophenyl)-1-phenylcyclopentane-1-carboxamideN-(3-NITROPHENYL)(PHENYLCYCLOPENTYL)FORMAMIDEMFCD01190874Oprea1_598439Oprea1_753182DNA96480AKOS003199058MS-10186N-(3-nitrophenyl)-1-phenyl-cyclopentanecarboxamideSR-01000310390SR-01000310390-1
Show more names
N-(3-nitrophenyl)-1-phenylcyclopentanecarboxamideCyclopentanecarboxamide, N-(3-nitrophenyl)-1-phenyl-

Database identifiers

CAS
328964-80-3

Properties

Computed structural properties

XLogP
4
Topological polar surface area
74.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
23
Formal charge
0
Complexity
434

Physicochemical properties

Boiling point
520.9 · 520.9±43.0 °C(Predicted)
Density
1.283 · 1.283±0.06 g/cm3(Predicted)
pka
13.85 · 13.85±0.70(Predicted)

Related reactions

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Compound notes

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