Home Other Building Blocks 3-(cyclopropylsulfamoyl)-4-methoxybenzoic acid

3-(cyclopropylsulfamoyl)-4-methoxybenzoic acid

CAS No.:
716358-76-8
Catalog Number:
AG019O8S
Molecular Formula:
C11H13NO5S
Molecular Weight:
271.2896
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Product Description
Catalog Number:
AG019O8S
Chemical Name:
3-(cyclopropylsulfamoyl)-4-methoxybenzoic acid
CAS Number:
716358-76-8
Molecular Formula:
C11H13NO5S
Molecular Weight:
271.2896
MDL Number:
MFCD06655683
IUPAC Name:
3-(cyclopropylsulfamoyl)-4-methoxybenzoic acid
InChI:
InChI=1S/C11H13NO5S/c1-17-9-5-2-7(11(13)14)6-10(9)18(15,16)12-8-3-4-8/h2,5-6,8,12H,3-4H2,1H3,(H,13,14)
InChI Key:
GOSJCWHCEGBHOT-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1S(=O)(=O)NC1CC1)C(=O)O
Properties
Complexity:
412  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.051g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
271.287g/mol
Monoisotopic Mass:
271.051g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties