Home Carboxys 2-amino-4-ethyl-1,3-thiazole-5-carboxylic acid

2-amino-4-ethyl-1,3-thiazole-5-carboxylic acid

CAS No.:
191105-37-0
Catalog Number:
AG00ACW6
Molecular Formula:
C6H8N2O2S
Molecular Weight:
172.2049
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Product Description
Catalog Number:
AG00ACW6
Chemical Name:
2-amino-4-ethyl-1,3-thiazole-5-carboxylic acid
CAS Number:
191105-37-0
Molecular Formula:
C6H8N2O2S
Molecular Weight:
172.2049
MDL Number:
MFCD13188627
IUPAC Name:
2-amino-4-ethyl-1,3-thiazole-5-carboxylic acid
InChI:
InChI=1S/C6H8N2O2S/c1-2-3-4(5(9)10)11-6(7)8-3/h2H2,1H3,(H2,7,8)(H,9,10)
InChI Key:
OHUPJQLYQCVDHP-UHFFFAOYSA-N
SMILES:
CCc1nc(sc1C(=O)O)N
Properties
Complexity:
165  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.031g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
172.202g/mol
Monoisotopic Mass:
172.031g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties