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1016715-95-9

1016715-95-9 | Benzenesulfonyl chloride, 3-[(methylamino)carbonyl]-

CAS No: 1016715-95-9 Catalog No: AG00055A MDL No:MFCD09814233

Product Description

Catalog Number:
AG00055A
Chemical Name:
Benzenesulfonyl chloride, 3-[(methylamino)carbonyl]-
CAS Number:
1016715-95-9
Molecular Formula:
C8H8ClNO3S
Molecular Weight:
233.6720
MDL Number:
MFCD09814233
IUPAC Name:
3-(methylcarbamoyl)benzenesulfonyl chloride
InChI:
InChI=1S/C8H8ClNO3S/c1-10-8(11)6-3-2-4-7(5-6)14(9,12)13/h2-5H,1H3,(H,10,11)
InChI Key:
XRJDVAPXWOSTLA-UHFFFAOYSA-N
SMILES:
CNC(=O)c1cccc(c1)S(=O)(=O)Cl

Properties

Complexity:
309  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.991g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.666g/mol
Monoisotopic Mass:
232.991g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

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