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2-chloro-3-nitrophenol

2-chloro-3-nitrophenol

CAS: 603-84-9

Formula: C6H4ClNO3

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

IUPAC: 2-chloro-3-nitrophenol

InChI: InChI=1S/C6H4ClNO3/c7-6-4(8(10)11)2-1-3-5(6)9/h1-3,9H

Composition: C (41.52%), H (2.32%), Cl (20.43%), N (8.07%), O (27.66%)

Molar Mass: 173.55

Atom Count: 15

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 172.9879707
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey QBGLHYQUZJDZOO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 39.16
Topological Polar Surface Area 63.37
Polarizability 14.87
Ring Count 1
Rotatable Bond Count 1

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