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Home > Nitro Compounds > 639824-67-2
639824-67-2 | 2-Nitrobenzenesulfenyl chloride-13C6
CAS No: 639824-67-2 Catalog No: AG00F9QE MDL No:
Product Description
Catalog Number:
AG00F9QE
Chemical Name:
2-Nitrobenzenesulfenyl chloride-13C6
CAS Number:
639824-67-2
IUPAC Name:
(6-nitro(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl) thiohypochlorite
InChI:
InChI=1S/C6H4ClNO2S/c7-11-6-4-2-1-3-5(6)8(9)10/h1-4H/i1+1,2+1,3+1,4+1,5+1,6+1
InChI Key:
NTNKNFHIAFDCSJ-IDEBNGHGSA-N
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.985g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
6
Molecular Weight:
195.567g/mol
Monoisotopic Mass:
194.985g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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