Home Sulfos 4-(1-carbamoyl-1-methylethyl)benzene-1-sulfonyl chloride

4-(1-carbamoyl-1-methylethyl)benzene-1-sulfonyl chloride

CAS No.:
1342111-86-7
Catalog Number:
AG01B35C
Molecular Formula:
C10H12ClNO3S
Molecular Weight:
261.7252
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Product Description
Catalog Number:
AG01B35C
Chemical Name:
4-(1-carbamoyl-1-methylethyl)benzene-1-sulfonyl chloride
CAS Number:
1342111-86-7
Molecular Formula:
C10H12ClNO3S
Molecular Weight:
261.7252
MDL Number:
MFCD20405515
IUPAC Name:
4-(1-amino-2-methyl-1-oxopropan-2-yl)benzenesulfonyl chloride
InChI:
InChI=1S/C10H12ClNO3S/c1-10(2,9(12)13)7-3-5-8(6-4-7)16(11,14)15/h3-6H,1-2H3,(H2,12,13)
InChI Key:
DYYLJEOAYUWFIA-UHFFFAOYSA-N
SMILES:
NC(=O)C(c1ccc(cc1)S(=O)(=O)Cl)(C)C
Properties
Complexity:
364  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.023g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
261.72g/mol
Monoisotopic Mass:
261.023g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
85.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties