Home Carboxys 2-Isopropyl-4-methyl-1,3-thiazole-5-carboxylic acid

2-Isopropyl-4-methyl-1,3-thiazole-5-carboxylic acid

CAS No.:
137267-29-9
Catalog Number:
AG001319
Molecular Formula:
C8H11NO2S
Molecular Weight:
185.2434
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$129
- +
5g
95%
In Stock USA
United States
$316
- +
Product Description
Catalog Number:
AG001319
Chemical Name:
2-Isopropyl-4-methyl-1,3-thiazole-5-carboxylic acid
CAS Number:
137267-29-9
Molecular Formula:
C8H11NO2S
Molecular Weight:
185.2434
MDL Number:
MFCD09864423
IUPAC Name:
4-methyl-2-propan-2-yl-1,3-thiazole-5-carboxylic acid
InChI:
InChI=1S/C8H11NO2S/c1-4(2)7-9-5(3)6(12-7)8(10)11/h4H,1-3H3,(H,10,11)
InChI Key:
MLCHZLUFNGBRSL-UHFFFAOYSA-N
SMILES:
CC(c1nc(c(s1)C(=O)O)C)C
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.051g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
185.241g/mol
Monoisotopic Mass:
185.051g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties