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101736-22-5,MFCD00277218
Catalog No.:AA00059N
101736-22-5 | 2-(5-Methyl-2-phenylthiazole-4-yl)acetic acid
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250mg
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$147.00   $103.00
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1g
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Technical Information
Catalog Number:
AA00059N
Chemical Name:
2-(5-Methyl-2-phenylthiazole-4-yl)acetic acid
CAS Number:
101736-22-5
Molecular Formula:
C12H11NO2S
Molecular Weight:
233.2862
MDL Number:
MFCD00277218
IUPAC Name:
2-(5-methyl-2-phenyl-1,3-thiazol-4-yl)acetic acid
InChI:
InChI=1S/C12H11NO2S/c1-8-10(7-11(14)15)13-12(16-8)9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,14,15)
InChI Key:
SZYXURFSAUXFNT-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1nc(sc1C)c1ccccc1
Properties
Computed Properties
 
Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.051g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.285g/mol
Monoisotopic Mass:
233.051g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

Synonyms
 
101736-22-5 
2-(5-methyl-2-phenylthiazol-4-yl)acetic acid 
SCHEMBL3537226 
CTK4A0169 
DTXSID30374988 
SZYXURFSAUXFNT-UHFFFAOYSA-N 
ZINC2565056 
ZX-AT002253 
7429AC 
MFCD00277218 
SBB005434 
AKOS005071577 
2-(5-methyl-2-phenyl-1,3-thiazol-4-yl)acetic Acid 
AA-0718 
MCULE-5249832481 
OR15233 
RP13410 
RTR-000426 
VT10027 
KS-000021W9 
CC-05955 
4-Thiazoleacetic acid, 5-methyl-2-phenyl- 
TR-000426 
2-(5-Methyl-2-phenylthiazole-4-yl)acetic acid 
FT-0642461 
(5-methyl-2-phenylthiazole-4-yl)acetic acid 
(5-methyl-2-phenyl-thiazol-4-yl)-acetic acid 
K-0248 
C-13702 
I04-4529 
J-506141 
C12H11NO2S 
CID2760017 
5-methyl-2-phenyl-4-Thiazoleacetic acid 
(5-methyl-2-phenyl-1,3-thiazol-4-yl)acetic acid 
4-Thiazoleacetic acid,5-methyl-2-phenyl- 
AC1MC1QD 
ACMC-1BT72 
Oprea1_546823 
methylphenylthiazolylaceticacid 
Literature
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