Home Carboxys 2-(Methoxymethyl)thiazole-4-carboxylic acid

2-(Methoxymethyl)thiazole-4-carboxylic acid

CAS No.:
1086380-07-5
Catalog Number:
AG007UHK
Molecular Formula:
C6H7NO3S
Molecular Weight:
173.1897
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Product Description
Catalog Number:
AG007UHK
Chemical Name:
2-(Methoxymethyl)thiazole-4-carboxylic acid
CAS Number:
1086380-07-5
Molecular Formula:
C6H7NO3S
Molecular Weight:
173.1897
MDL Number:
MFCD09258843
IUPAC Name:
2-(methoxymethyl)-1,3-thiazole-4-carboxylic acid
InChI:
InChI=1S/C6H7NO3S/c1-10-2-5-7-4(3-11-5)6(8)9/h3H,2H2,1H3,(H,8,9)
InChI Key:
PIAYLONXKHUMGZ-UHFFFAOYSA-N
SMILES:
COCc1nc(cs1)C(=O)O
Properties
Complexity:
153  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.015g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
173.186g/mol
Monoisotopic Mass:
173.015g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
87.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties