Home Sulfos ethyl 3-(chlorosulfonyl)-4-methylbenzoate

ethyl 3-(chlorosulfonyl)-4-methylbenzoate

CAS No.:
924871-96-5
Catalog Number:
AG01BCUX
Molecular Formula:
C10H11ClO4S
Molecular Weight:
262.7099
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Product Description
Catalog Number:
AG01BCUX
Chemical Name:
ethyl 3-(chlorosulfonyl)-4-methylbenzoate
CAS Number:
924871-96-5
Molecular Formula:
C10H11ClO4S
Molecular Weight:
262.7099
MDL Number:
MFCD11057849
IUPAC Name:
ethyl 3-chlorosulfonyl-4-methylbenzoate
InChI:
InChI=1S/C10H11ClO4S/c1-3-15-10(12)8-5-4-7(2)9(6-8)16(11,13)14/h4-6H,3H2,1-2H3
InChI Key:
MBXNHYWLMGGEIV-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(c(c1)S(=O)(=O)Cl)C
Properties
Complexity:
346  
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:
4  
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties