Home Carboxys 2-(4-butoxy-3-cyanophenyl)-4-methylthiazole-5-carboxylic acid

2-(4-butoxy-3-cyanophenyl)-4-methylthiazole-5-carboxylic acid

CAS No.:
1657014-33-9
Catalog Number:
AG00AQFJ
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00AQFJ
Chemical Name:
2-(4-butoxy-3-cyanophenyl)-4-methylthiazole-5-carboxylic acid
CAS Number:
1657014-33-9
IUPAC Name:
2-(4-butoxy-3-cyanophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid
InChI:
InChI=1S/C16H16N2O3S/c1-3-4-7-21-13-6-5-11(8-12(13)9-17)15-18-10(2)14(22-15)16(19)20/h5-6,8H,3-4,7H2,1-2H3,(H,19,20)
InChI Key:
KFYGOMDVRIXGBJ-UHFFFAOYSA-N
Properties
Complexity:
436  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.088g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
316.375g/mol
Monoisotopic Mass:
316.088g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties