1-(4-methoxy-2-nitrophenyl)propan-2-one

1-(4-methoxy-2-nitrophenyl)propan-2-one

CAS: 113352-66-2

Formula: C10H11NO4

SMILES: COC1=CC(=C(CC(C)=O)C=C1)[N+]([O-])=O

IUPAC: 1-(4-methoxy-2-nitrophenyl)propan-2-one

InChI: InChI=1S/C10H11NO4/c1-7(12)5-8-3-4-9(15-2)6-10(8)11(13)14/h3-4,6H,5H2,1-2H3

Composition: C (57.41%), H (5.30%), N (6.70%), O (30.59%)

Molar Mass: 209.201

Atom Count: 26

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	209.068807838
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	WHTPGMMGMTXQEC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.7
Topological Polar Surface Area	69.44
Polarizability	20.36
Ring Count	1
Rotatable Bond Count	4

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