Home Oxazoles 252928-82-8
252928-82-8,MFCD06797481
Catalog No.:AA003I2X
252928-82-8 | 3-(1,3-Oxazol-5-yl)benzoic acid
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250mg
95%
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$260.00   $182.00
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1g
95%
in stock  
$279.00   $196.00
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  • Technical Information
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  • Technical Information
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Technical Information
Catalog Number:
AA003I2X
Chemical Name:
3-(1,3-Oxazol-5-yl)benzoic acid
CAS Number:
252928-82-8
Molecular Formula:
C10H7NO3
Molecular Weight:
189.1675
MDL Number:
MFCD06797481
IUPAC Name:
3-(1,3-oxazol-5-yl)benzoic acid
InChI:
InChI=1S/C10H7NO3/c12-10(13)8-3-1-2-7(4-8)9-5-11-6-14-9/h1-6H,(H,12,13)
InChI Key:
GDGXRJDVOKNSCX-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc(c1)c1cnco1
Properties
Computed Properties
 
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.043g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.17g/mol
Monoisotopic Mass:
189.043g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

Synonyms
 
252928-82-8 
3-(1,3-oxazol-5-yl)benzoic Acid 
CTK1A1261 
KS-00000CNG 
DTXSID60427810 
GDGXRJDVOKNSCX-UHFFFAOYSA-N 
ZINC4200683 
ANW-46695 
SBB052813 
AKOS006344973 
MCULE-3534651987 
RP03644 
3-(Oxazol-5-yl)benzoic acid 
TRA0030930 
AJ-48312 
AK-83375 
SY012414 
TS-02663 
AB0023733 
RT-008261 
ST2417408 
AM20040029 
CS-0060395 
3-(5-Oxazolyl)benzoic Acid 
FT-0696657 
W4861 
AZ0001-0576 
MFCD06797481 (95%) 
3-(1,3-oxazol-5-yl)benzoic acid, AldrichCPR 
Z-4174 
W-206943 
Z2236735330 
3- benzoicacid 
C10H7NO3 
Benzoic acid, 3-(5-oxazolyl)- 
CID7127813 
MFCD06797481 
AC1OFHSO 
3-(5-Oxazolyl)benzoicAcid 
SCHEMBL940586 
Benzoicacid, 3-(5-oxazolyl)- 
Literature
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