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20201-06-3 | Benzenesulfenyl chloride, 2-chloro-4-nitro-
CAS No: 20201-06-3 Catalog No: AG00280Y MDL No:
Product Description
Catalog Number:
AG00280Y
Chemical Name:
Benzenesulfenyl chloride, 2-chloro-4-nitro-
CAS Number:
20201-06-3
Molecular Formula:
C6H3Cl2NO2S
Molecular Weight:
224.0645
IUPAC Name:
(2-chloro-4-nitrophenyl) thiohypochlorite
InChI:
InChI=1S/C6H3Cl2NO2S/c7-5-3-4(9(10)11)1-2-6(5)12-8/h1-3H
InChI Key:
RQCHGROTARKLQK-UHFFFAOYSA-N
SMILES:
ClSc1ccc(cc1Cl)[N+](=O)[O-]
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.926g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.055g/mol
Monoisotopic Mass:
222.926g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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