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17969-24-3 | 4-Thiazoleacetic acid, 2-(4-fluorophenyl)-
CAS No: 17969-24-3 Catalog No: AG00277H MDL No:MFCD06366744
Product Description
Catalog Number:
AG00277H
Chemical Name:
4-Thiazoleacetic acid, 2-(4-fluorophenyl)-
CAS Number:
17969-24-3
Molecular Formula:
C11H8FNO2S
Molecular Weight:
237.2501
MDL Number:
MFCD06366744
IUPAC Name:
2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]acetic acid
InChI:
InChI=1S/C11H8FNO2S/c12-8-3-1-7(2-4-8)11-13-9(6-16-11)5-10(14)15/h1-4,6H,5H2,(H,14,15)
InChI Key:
QOJQFOYPWWTPCA-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1csc(n1)c1ccc(cc1)F
Properties
Complexity:
256
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:
3
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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