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o-chloronitrobenzene

o-chloronitrobenzene

CAS: 88-73-3

Formula: C6H4ClNO2

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

IUPAC: 1-chloro-2-nitrobenzene

InChI: InChI=1S/C6H4ClNO2/c7-5-3-1-2-4-6(5)8(9)10/h1-4H

Composition: C (45.74%), H (2.56%), Cl (22.50%), N (8.89%), O (20.31%)

Molar Mass: 157.55

Atom Count: 14

Heavy Atom Count: 10

Properties
Properties
Common Names O-chloronitrobenzene
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 156.9930561
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey BFCFYVKQTRLZHA-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 37.18
Topological Polar Surface Area 43.14
Polarizability 14.17
Ring Count 1
Rotatable Bond Count 1

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Purity LeadTime CAS UnitPrice
99% <10 Days 88-73-3 Quote Only