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Home > Nitro Compounds > 1351619-22-1
1351619-22-1 | 4-(3-Nitrophenoxy)benzenesulfonyl chloride
CAS No: 1351619-22-1 Catalog No: AG01FN0P MDL No:MFCD21092079
Product Description
Catalog Number:
AG01FN0P
Chemical Name:
4-(3-Nitrophenoxy)benzenesulfonyl chloride
CAS Number:
1351619-22-1
Molecular Formula:
C12H8ClNO5S
Molecular Weight:
313.7136
MDL Number:
MFCD21092079
IUPAC Name:
4-(3-nitrophenoxy)benzenesulfonyl chloride
InChI:
InChI=1S/C12H8ClNO5S/c13-20(17,18)12-6-4-10(5-7-12)19-11-3-1-2-9(8-11)14(15)16/h1-8H
InChI Key:
TURHQWOQNPGGPU-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)Oc1ccc(cc1)S(=O)(=O)Cl
Properties
Complexity:
436
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.981g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
313.708g/mol
Monoisotopic Mass:
312.981g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
97.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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