Home Other Building Blocks 2-[5-(4-methylphenyl)-1,3-oxazol-2-yl]benzoic acid

2-[5-(4-methylphenyl)-1,3-oxazol-2-yl]benzoic acid

CAS No.:
88877-88-7
Catalog Number:
AG019OO8
Molecular Formula:
C17H13NO3
Molecular Weight:
279.2900
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Product Description
Catalog Number:
AG019OO8
Chemical Name:
2-[5-(4-methylphenyl)-1,3-oxazol-2-yl]benzoic acid
CAS Number:
88877-88-7
Molecular Formula:
C17H13NO3
Molecular Weight:
279.2900
MDL Number:
MFCD00491494
IUPAC Name:
2-[5-(4-methylphenyl)-1,3-oxazol-2-yl]benzoic acid
InChI:
InChI=1S/C17H13NO3/c1-11-6-8-12(9-7-11)15-10-18-16(21-15)13-4-2-3-5-14(13)17(19)20/h2-10H,1H3,(H,19,20)
InChI Key:
QHDXXCCWUXBCLN-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)c1cnc(o1)c1ccccc1C(=O)O
Properties
Complexity:
365  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.09g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
279.295g/mol
Monoisotopic Mass:
279.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
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
Properties