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80259-15-0

80259-15-0 | 2-(4-NITRO-PHENYL)-ETHANESULFONYL CHLORIDE

CAS No: 80259-15-0 Catalog No: AG00G80A MDL No:MFCD06657958

Product Description

Catalog Number:
AG00G80A
Chemical Name:
2-(4-NITRO-PHENYL)-ETHANESULFONYL CHLORIDE
CAS Number:
80259-15-0
Molecular Formula:
C8H8ClNO4S
Molecular Weight:
249.6714
MDL Number:
MFCD06657958
IUPAC Name:
2-(4-nitrophenyl)ethanesulfonyl chloride
InChI:
InChI=1S/C8H8ClNO4S/c9-15(13,14)6-5-7-1-3-8(4-2-7)10(11)12/h1-4H,5-6H2
InChI Key:
LCUFMYFBIXFCMV-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)CCS(=O)(=O)Cl

Properties

Complexity:
311  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.986g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.665g/mol
Monoisotopic Mass:
248.986g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
88.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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