200,000+ products from a single source!
sales@angenechem.com
89668-03-1 | Benzoic acid, 2-hydroxy-4-[[3-phenyl-3-(3-pyridinyl)-2-propenyl]oxy]-
CAS No: 89668-03-1 Catalog No: AG0043HR MDL No:
Product Description
Catalog Number:
AG0043HR
Chemical Name:
Benzoic acid, 2-hydroxy-4-[[3-phenyl-3-(3-pyridinyl)-2-propenyl]oxy]-
CAS Number:
89668-03-1
Molecular Formula:
C21H17NO4
Molecular Weight:
347.3640
IUPAC Name:
2-hydroxy-4-(3-phenyl-3-pyridin-3-ylprop-2-enoxy)benzoic acid
InChI:
InChI=1S/C21H17NO4/c23-20-13-17(8-9-19(20)21(24)25)26-12-10-18(15-5-2-1-3-6-15)16-7-4-11-22-14-16/h1-11,13-14,23H,12H2,(H,24,25)
InChI Key:
WGCCWPQQQSXVTO-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1O)OCC=C(c1cccnc1)c1ccccc1
Properties
Complexity:
486
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.116g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
347.37g/mol
Monoisotopic Mass:
347.116g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
79.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.