Home Other Building Blocks 2-(ETHOXYMETHYL)-1,3-THIAZOLE-4-CARBOXYLIC ACID

2-(ETHOXYMETHYL)-1,3-THIAZOLE-4-CARBOXYLIC ACID

CAS No.:
1495157-12-4
Catalog Number:
AG01EK82
Molecular Formula:
C7H9NO3S
Molecular Weight:
187.2163
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Product Description
Catalog Number:
AG01EK82
Chemical Name:
2-(ETHOXYMETHYL)-1,3-THIAZOLE-4-CARBOXYLIC ACID
CAS Number:
1495157-12-4
Molecular Formula:
C7H9NO3S
Molecular Weight:
187.2163
MDL Number:
MFCD20959050
IUPAC Name:
2-(ethoxymethyl)-1,3-thiazole-4-carboxylic acid
InChI:
InChI=1S/C7H9NO3S/c1-2-11-3-6-8-5(4-12-6)7(9)10/h4H,2-3H2,1H3,(H,9,10)
InChI Key:
CIRBYBHKRRMQFQ-UHFFFAOYSA-N
SMILES:
CCOCc1nc(cs1)C(=O)O
Properties
Complexity:
165  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.03g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
187.213g/mol
Monoisotopic Mass:
187.03g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
87.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties