Home Sulfos 3-carbamoyl-5-methylbenzene-1-sulfonyl chloride

3-carbamoyl-5-methylbenzene-1-sulfonyl chloride

CAS No.:
1478003-33-6
Catalog Number:
AG01B2FT
Molecular Formula:
C8H8ClNO3S
Molecular Weight:
233.6720
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Product Description
Catalog Number:
AG01B2FT
Chemical Name:
3-carbamoyl-5-methylbenzene-1-sulfonyl chloride
CAS Number:
1478003-33-6
Molecular Formula:
C8H8ClNO3S
Molecular Weight:
233.6720
MDL Number:
MFCD21196012
IUPAC Name:
3-carbamoyl-5-methylbenzenesulfonyl chloride
InChI:
InChI=1S/C8H8ClNO3S/c1-5-2-6(8(10)11)4-7(3-5)14(9,12)13/h2-4H,1H3,(H2,10,11)
InChI Key:
APOATSPUECMEHO-UHFFFAOYSA-N
SMILES:
Cc1cc(cc(c1)S(=O)(=O)Cl)C(=O)N
Properties
Complexity:
322  
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:
85.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties