Home Carboxys 2-(1-methoxyethyl)-4-methyl-1,3-thiazole-5-carboxylic acid

2-(1-methoxyethyl)-4-methyl-1,3-thiazole-5-carboxylic acid

CAS No.:
1376219-45-2
Catalog Number:
AG019U2I
Molecular Formula:
C8H11NO3S
Molecular Weight:
201.2428
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Product Description
Catalog Number:
AG019U2I
Chemical Name:
2-(1-methoxyethyl)-4-methyl-1,3-thiazole-5-carboxylic acid
CAS Number:
1376219-45-2
Molecular Formula:
C8H11NO3S
Molecular Weight:
201.2428
MDL Number:
MFCD21938392
IUPAC Name:
2-(1-methoxyethyl)-4-methyl-1,3-thiazole-5-carboxylic acid
InChI:
InChI=1S/C8H11NO3S/c1-4-6(8(10)11)13-7(9-4)5(2)12-3/h5H,1-3H3,(H,10,11)
InChI Key:
MRPRAILKWZVBOV-UHFFFAOYSA-N
SMILES:
COC(c1nc(c(s1)C(=O)O)C)C
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.046g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
201.24g/mol
Monoisotopic Mass:
201.046g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
87.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties