Home Carboxys 2-(4-Fluorophenyl)-4-methyl-5-thiazolecarboxylicacid

2-(4-Fluorophenyl)-4-methyl-5-thiazolecarboxylicacid

CAS No.:
144060-99-1
Catalog Number:
AG00AC14
Molecular Formula:
C11H8FNO2S
Molecular Weight:
237.2501
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Product Description
Catalog Number:
AG00AC14
Chemical Name:
2-(4-Fluorophenyl)-4-methyl-5-thiazolecarboxylicacid
CAS Number:
144060-99-1
Molecular Formula:
C11H8FNO2S
Molecular Weight:
237.2501
MDL Number:
MFCD06857923
IUPAC Name:
2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid
InChI:
InChI=1S/C11H8FNO2S/c1-6-9(11(14)15)16-10(13-6)7-2-4-8(12)5-3-7/h2-5H,1H3,(H,14,15)
InChI Key:
LPBSLIRPWIFCQT-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)c1nc(c(s1)C(=O)O)C
Properties
Complexity:
269  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.026g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
237.248g/mol
Monoisotopic Mass:
237.026g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties