2-(3-nitrobenzoyl)phenyl acetate

2-(3-nitrobenzoyl)phenyl acetate

CAS: 890098-32-5

Formula: C15H11NO5

SMILES: CC(=O)OC1=CC=CC=C1C(=O)C1=CC=CC(=C1)[N+]([O-])=O

IUPAC: 2-(3-nitrobenzoyl)phenyl acetate

InChI: InChI=1S/C15H11NO5/c1-10(17)21-14-8-3-2-7-13(14)15(18)11-5-4-6-12(9-11)16(19)20/h2-9H,1H3

Composition: C (63.16%), H (3.89%), N (4.91%), O (28.04%)

Molar Mass: 285.255

Atom Count: 32

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	285.063722458
Formal Charge	0
FSP3	0.07
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	PBFJQQPWFUZHLW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	74.09
Topological Polar Surface Area	86.51
Polarizability	28.3
Ring Count	2
Rotatable Bond Count	5

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