200,000+ products from a single source!
sales@angenechem.com
1048918-56-4 | 4-(4,5-Dimethyloxazol-2-yl)benzoic acid
CAS No: 1048918-56-4 Catalog No: AG01FC61 MDL No:
Product Description
Catalog Number:
AG01FC61
Chemical Name:
4-(4,5-Dimethyloxazol-2-yl)benzoic acid
CAS Number:
1048918-56-4
Molecular Formula:
C12H11NO3
Molecular Weight:
217.2206
IUPAC Name:
4-(4,5-dimethyl-1,3-oxazol-2-yl)benzoic acid
InChI:
InChI=1S/C12H11NO3/c1-7-8(2)16-11(13-7)9-3-5-10(6-4-9)12(14)15/h3-6H,1-2H3,(H,14,15)
InChI Key:
FKNSFXRDSCZSIG-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)c1oc(c(n1)C)C
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.074g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
217.224g/mol
Monoisotopic Mass:
217.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.