Home Sulfos ethyl 3-(chlorosulfonyl)-5-(methoxymethyl)benzoate

ethyl 3-(chlorosulfonyl)-5-(methoxymethyl)benzoate

CAS No.:
1154568-86-1
Catalog Number:
AG01ALD8
Molecular Formula:
C11H13ClO5S
Molecular Weight:
292.7359
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Product Description
Catalog Number:
AG01ALD8
Chemical Name:
ethyl 3-(chlorosulfonyl)-5-(methoxymethyl)benzoate
CAS Number:
1154568-86-1
Molecular Formula:
C11H13ClO5S
Molecular Weight:
292.7359
MDL Number:
MFCD11979542
IUPAC Name:
ethyl 3-chlorosulfonyl-5-(methoxymethyl)benzoate
InChI:
InChI=1S/C11H13ClO5S/c1-3-17-11(13)9-4-8(7-16-2)5-10(6-9)18(12,14)15/h4-6H,3,7H2,1-2H3
InChI Key:
QJIQAMHVZSBHCD-UHFFFAOYSA-N
SMILES:
COCc1cc(cc(c1)S(=O)(=O)Cl)C(=O)OCC
Properties
Complexity:
375  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.017g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
292.73g/mol
Monoisotopic Mass:
292.017g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
78A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties