200,000+ products from a single source!
sales@angenechem.com
890100-57-9 | ETHYL 6-(2-CHLORO-PYRIDIN-3-YL)-6-OXOHEXANOATE
CAS No: 890100-57-9 Catalog No: AG0042VA MDL No:
Product Description
Catalog Number:
AG0042VA
Chemical Name:
ETHYL 6-(2-CHLORO-PYRIDIN-3-YL)-6-OXOHEXANOATE
CAS Number:
890100-57-9
Molecular Formula:
C13H16ClNO3
Molecular Weight:
269.7240
IUPAC Name:
ethyl 6-(2-chloropyridin-3-yl)-6-oxohexanoate
InChI:
InChI=1S/C13H16ClNO3/c1-2-18-12(17)8-4-3-7-11(16)10-6-5-9-15-13(10)14/h5-6,9H,2-4,7-8H2,1H3
InChI Key:
BPHICZTWHFSTKX-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCCCC(=O)c1cccnc1Cl
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.082g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.725g/mol
Monoisotopic Mass:
269.082g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
56.3A^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.