Home Sulfos methyl 2-[4-(chlorosulfonyl)phenyl]-2-methylpropanoate

methyl 2-[4-(chlorosulfonyl)phenyl]-2-methylpropanoate

CAS No.:
612532-24-8
Catalog Number:
AG01BESO
Molecular Formula:
C11H13ClO4S
Molecular Weight:
276.7365
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Product Description
Catalog Number:
AG01BESO
Chemical Name:
methyl 2-[4-(chlorosulfonyl)phenyl]-2-methylpropanoate
CAS Number:
612532-24-8
Molecular Formula:
C11H13ClO4S
Molecular Weight:
276.7365
MDL Number:
MFCD21235078
IUPAC Name:
methyl 2-(4-chlorosulfonylphenyl)-2-methylpropanoate
InChI:
InChI=1S/C11H13ClO4S/c1-11(2,10(13)16-3)8-4-6-9(7-5-8)17(12,14)15/h4-7H,1-3H3
InChI Key:
NPFVNPWHDAQPEE-UHFFFAOYSA-N
SMILES:
COC(=O)C(c1ccc(cc1)S(=O)(=O)Cl)(C)C
Properties
Complexity:
375  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.022g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.731g/mol
Monoisotopic Mass:
276.022g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties