C1=CC(=C(C=C1[N+](=O)[O-])Cl)O
CAS: 619-08-9
Name: 2-chloro-4-nitrophenol
SMILES: C1=CC(=C(C=C1[N+](=O)[O-])Cl)O

Molecular Processing

Molecular formula
C6H4ClNO3
Molecular weight
173.56
Exact mass
172.988
XLogP
1.95
TPSA
63.37
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
39.77

Supplementary Information

InChIKey: BOFRXDMCQRTGII-UHFFFAOYSA-N
Synonyme
2-CHLORO-4-NITROPHENOL619-08-9NitrofunginPhenol, 2-chloro-4-nitro-NitrofurginY2V03M9UL8NSC-1316DTXSID0060694RefChem:86263DTXCID7043166210-578-8MFCD000439102-Chloro-4-nitro-phenol2-Chloranyl-4-Nitro-PhenolPhenol, chloro-4-nitro-2-Chloro-4-Nitro PhenolNSC 1316EINECS 210-578-8BRN 2046372UNII-Y2V03M9UL8NSC1316P9P2-chloro-4nitrophenol2-chloro,4-nitrophenol2-chloro4-nitro-phenolWLN: WNR DQ CGSCHEMBL140502CHEMBL150824orb1298089SCHEMBL6646592
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