Home Other Building Blocks (4-Phenyl-thiazol-2-yl)-acetic acid

(4-Phenyl-thiazol-2-yl)-acetic acid

CAS No.:
38107-10-7
Catalog Number:
AG00BYWI
Molecular Formula:
C11H9NO2S
Molecular Weight:
219.2597
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Product Description
Catalog Number:
AG00BYWI
Chemical Name:
(4-Phenyl-thiazol-2-yl)-acetic acid
CAS Number:
38107-10-7
Molecular Formula:
C11H9NO2S
Molecular Weight:
219.2597
MDL Number:
MFCD05177043
IUPAC Name:
2-(4-phenyl-1,3-thiazol-2-yl)acetic acid
InChI:
InChI=1S/C11H9NO2S/c13-11(14)6-10-12-9(7-15-10)8-4-2-1-3-5-8/h1-5,7H,6H2,(H,13,14)
InChI Key:
OLQHHTZTEVMZLC-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1scc(n1)c1ccccc1
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.035g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
219.258g/mol
Monoisotopic Mass:
219.035g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties