200,000+ products from a single source!
sales@angenechem.com
87848-03-1 | 5-Pyrimidinecarboxylic acid, 2,4,6-trichloro-, 4-chlorophenyl ester
CAS No: 87848-03-1 Catalog No: AG004EKV MDL No:
Product Description
Catalog Number:
AG004EKV
Chemical Name:
5-Pyrimidinecarboxylic acid, 2,4,6-trichloro-, 4-chlorophenyl ester
CAS Number:
87848-03-1
Molecular Formula:
C11H4Cl4N2O2
Molecular Weight:
337.9737
IUPAC Name:
(4-chlorophenyl) 2,4,6-trichloropyrimidine-5-carboxylate
InChI:
InChI=1S/C11H4Cl4N2O2/c12-5-1-3-6(4-2-5)19-10(18)7-8(13)16-11(15)17-9(7)14/h1-4H
InChI Key:
XIBVGIBTKHACHL-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)OC(=O)c1c(Cl)nc(nc1Cl)Cl
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
337.9g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
337.965g/mol
Monoisotopic Mass:
335.903g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
Related Products
© 2019 Angene International Limited. All rights Reserved.