1-(4-aminophenyl)-3-(2-nitrophenyl)prop-2-en-1-one

1-(4-aminophenyl)-3-(2-nitrophenyl)prop-2-en-1-one

CAS: 860403-51-6

Formula: C15H12N2O3

SMILES: NC1=CC=C(C=C1)C(=O)C=CC1=C(C=CC=C1)[N+]([O-])=O

IUPAC: 1-(4-aminophenyl)-3-(2-nitrophenyl)prop-2-en-1-one

InChI: InChI=1S/C15H12N2O3/c16-13-8-5-12(6-9-13)15(18)10-7-11-3-1-2-4-14(11)17(19)20/h1-10H,16H2

Composition: C (67.16%), H (4.51%), N (10.44%), O (17.89%)

Molar Mass: 268.272

Atom Count: 32

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	268.084792254
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	DIOHYNMOEIHTET-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	77.9
Topological Polar Surface Area	86.23
Polarizability	28.25
Ring Count	2
Rotatable Bond Count	4

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