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89502-09-0

89502-09-0 | 5-Thiazolecarboxylic acid, 4-(aminosulfonyl)-2-methyl-, ethyl ester

CAS No: 89502-09-0 Catalog No: AG0041FH MDL No:

Product Description

Catalog Number:
AG0041FH
Chemical Name:
5-Thiazolecarboxylic acid, 4-(aminosulfonyl)-2-methyl-, ethyl ester
CAS Number:
89502-09-0
Molecular Formula:
C7H10N2O4S2
Molecular Weight:
250.2953
IUPAC Name:
ethyl 2-methyl-4-sulfamoyl-1,3-thiazole-5-carboxylate
InChI:
InChI=1S/C7H10N2O4S2/c1-3-13-7(10)5-6(15(8,11)12)9-4(2)14-5/h3H2,1-2H3,(H2,8,11,12)
InChI Key:
JTUOZSVGJMMXSZ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1sc(nc1S(=O)(=O)N)C

Properties

Complexity:
337  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.008g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
250.287g/mol
Monoisotopic Mass:
250.008g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
136A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  

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