200,000+ products from a single source!

sales@angenechem.com

Home > Carboxes > 17859-53-9

17859-53-9

17859-53-9 | Acetic acid, 2-phenoxy-, 2,4,5-trichlorophenyl ester

CAS No: 17859-53-9 Catalog No: AG002666 MDL No:

Product Description

Catalog Number:
AG002666
Chemical Name:
Acetic acid, 2-phenoxy-, 2,4,5-trichlorophenyl ester
CAS Number:
17859-53-9
Molecular Formula:
C14H9Cl3O3
Molecular Weight:
331.5785
IUPAC Name:
(2,4,5-trichlorophenyl) 2-phenoxyacetate
InChI:
InChI=1S/C14H9Cl3O3/c15-10-6-12(17)13(7-11(10)16)20-14(18)8-19-9-4-2-1-3-5-9/h1-7H,8H2
InChI Key:
JNTRIYGIZHNYBS-UHFFFAOYSA-N
SMILES:
O=C(Oc1cc(Cl)c(cc1Cl)Cl)COc1ccccc1

Properties

Complexity:
321  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.962g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
331.573g/mol
Monoisotopic Mass:
329.962g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3  

© 2019 Angene International Limited. All rights Reserved.