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Home > Nitro Compounds > 101366-50-1
101366-50-1 | [1,1'-Biphenyl]-4-sulfonyl chloride, 3'-nitro-
CAS No: 101366-50-1 Catalog No: AG0004BG MDL No:
Product Description
Catalog Number:
AG0004BG
Chemical Name:
[1,1'-Biphenyl]-4-sulfonyl chloride, 3'-nitro-
CAS Number:
101366-50-1
Molecular Formula:
C12H8ClNO4S
Molecular Weight:
297.7142
IUPAC Name:
4-(3-nitrophenyl)benzenesulfonyl chloride
InChI:
InChI=1S/C12H8ClNO4S/c13-19(17,18)12-6-4-9(5-7-12)10-2-1-3-11(8-10)14(15)16/h1-8H
InChI Key:
KTXDVWDRGRWSJW-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)c1ccc(cc1)S(=O)(=O)Cl
Properties
Complexity:
420
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.986g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.709g/mol
Monoisotopic Mass:
296.986g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
88.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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