Home Sulfos 2-Methyl-6-nitrobenzene-1-sulfonyl chloride

2-Methyl-6-nitrobenzene-1-sulfonyl chloride

CAS No.:
56202-22-3
Catalog Number:
AG00E759
Molecular Formula:
C7H6ClNO4S
Molecular Weight:
235.6448
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Product Description
Catalog Number:
AG00E759
Chemical Name:
2-Methyl-6-nitrobenzene-1-sulfonyl chloride
CAS Number:
56202-22-3
Molecular Formula:
C7H6ClNO4S
Molecular Weight:
235.6448
MDL Number:
MFCD11505491
IUPAC Name:
2-methyl-6-nitrobenzenesulfonyl chloride
InChI:
InChI=1S/C7H6ClNO4S/c1-5-3-2-4-6(9(10)11)7(5)14(8,12)13/h2-4H,1H3
InChI Key:
BLIRLAVMSGHPBY-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1S(=O)(=O)Cl)C
Properties
Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.971g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.638g/mol
Monoisotopic Mass:
234.971g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
88.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties