Home Sulfos methyl 3-(chlorosulfonyl)-2-phenylpropanoate

methyl 3-(chlorosulfonyl)-2-phenylpropanoate

CAS No.:
1803560-95-3
Catalog Number:
AG01AFLI
Molecular Formula:
C10H11ClO4S
Molecular Weight:
262.7099
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Product Description
Catalog Number:
AG01AFLI
Chemical Name:
methyl 3-(chlorosulfonyl)-2-phenylpropanoate
CAS Number:
1803560-95-3
Molecular Formula:
C10H11ClO4S
Molecular Weight:
262.7099
MDL Number:
MFCD27980645
IUPAC Name:
methyl 3-chlorosulfonyl-2-phenylpropanoate
InChI:
InChI=1S/C10H11ClO4S/c1-15-10(12)9(7-16(11,13)14)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3
InChI Key:
WWYNHZWNQNGIPF-UHFFFAOYSA-N
SMILES:
COC(=O)C(c1ccccc1)CS(=O)(=O)Cl
Properties
Complexity:
327  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.007g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.704g/mol
Monoisotopic Mass:
262.007g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties