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

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

CAS No.:
472805-56-4
Catalog Number:
AG01A4MH
Molecular Formula:
C11H15NO2S
Molecular Weight:
225.3073
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Product Description
Catalog Number:
AG01A4MH
Chemical Name:
2-cyclohexyl-4-methyl-1,3-thiazole-5-carboxylic acid
CAS Number:
472805-56-4
Molecular Formula:
C11H15NO2S
Molecular Weight:
225.3073
MDL Number:
MFCD10007074
IUPAC Name:
2-cyclohexyl-4-methyl-1,3-thiazole-5-carboxylic acid
InChI:
InChI=1S/C11H15NO2S/c1-7-9(11(13)14)15-10(12-7)8-5-3-2-4-6-8/h8H,2-6H2,1H3,(H,13,14)
InChI Key:
JIDVCEPMJHOXPB-UHFFFAOYSA-N
SMILES:
OC(=O)c1sc(nc1C)C1CCCCC1
Properties
Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.082g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
225.306g/mol
Monoisotopic Mass:
225.082g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties