Home Carboxys 4-Thiazolecarboxylic acid, 5-amino-, methyl ester

4-Thiazolecarboxylic acid, 5-amino-, methyl ester

CAS No.:
1239464-24-4
Catalog Number:
AG000L93
Molecular Formula:
C5H6N2O2S
Molecular Weight:
158.1783
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Product Description
Catalog Number:
AG000L93
Chemical Name:
4-Thiazolecarboxylic acid, 5-amino-, methyl ester
CAS Number:
1239464-24-4
Molecular Formula:
C5H6N2O2S
Molecular Weight:
158.1783
MDL Number:
MFCD18432661
IUPAC Name:
methyl 5-amino-1,3-thiazole-4-carboxylate
InChI:
InChI=1S/C5H6N2O2S/c1-9-5(8)3-4(6)10-2-7-3/h2H,6H2,1H3
InChI Key:
OTNJGCAOEGZZMM-UHFFFAOYSA-N
SMILES:
COC(=O)c1ncsc1N
Properties
Complexity:
142  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.015g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
158.175g/mol
Monoisotopic Mass:
158.015g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
93.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties