200,000+ products from a single source!
sales@angenechem.com
87849-00-1 | 2-Pyridinepropanoic acid, 6-(4-methylbenzoyl)-, ethyl ester
CAS No: 87849-00-1 Catalog No: AG004EKS MDL No:
Product Description
Catalog Number:
AG004EKS
Chemical Name:
2-Pyridinepropanoic acid, 6-(4-methylbenzoyl)-, ethyl ester
CAS Number:
87849-00-1
Molecular Formula:
C18H19NO3
Molecular Weight:
297.3484
IUPAC Name:
ethyl 3-[6-(4-methylbenzoyl)pyridin-2-yl]propanoate
InChI:
InChI=1S/C18H19NO3/c1-3-22-17(20)12-11-15-5-4-6-16(19-15)18(21)14-9-7-13(2)8-10-14/h4-10H,3,11-12H2,1-2H3
InChI Key:
CHIFNFYDUIHOQU-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCc1cccc(n1)C(=O)c1ccc(cc1)C
Properties
Complexity:
375
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.136g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.354g/mol
Monoisotopic Mass:
297.136g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
56.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.