(4-chlorophenyl)methyl 2-(2-chlorophenoxy)acetate

C15H12Cl2O3 — CID 2378588

IUPAC(4-chlorophenyl)methyl 2-(2-chlorophenoxy)acetate
SMILESO=C(COc1ccccc1Cl)OCc1ccc(Cl)cc1
InChIInChI=1S/C15H12Cl2O3/c16-12-7-5-11(6-8-12)9-20-15(18)10-19-14-4-2-1-3-13(14)17/h1-8H,9-10H2
InChIKeyAYFKFGLJEGLDFE-UHFFFAOYSA-N
MW311.16 g/mol
LogP4.12
Rot. Bonds5

About (4-chlorophenyl)methyl 2-(2-chlorophenoxy)acetate

(4-chlorophenyl)methyl 2-(2-chlorophenoxy)acetate (PubChem CID 2378588) has the molecular formula C15H12Cl2O3 and a molecular weight of 311.16 g/mol. Its IUPAC name is (4-chlorophenyl)methyl 2-(2-chlorophenoxy)acetate.

Molecular Properties

Compound Name(4-chlorophenyl)methyl 2-(2-chlorophenoxy)acetate
PubChem CID2378588
Molecular FormulaC15H12Cl2O3
Molecular Weight311.16 g/mol
Exact Mass310.02
IUPAC Name(4-chlorophenyl)methyl 2-(2-chlorophenoxy)acetate
SMILESO=C(COc1ccccc1Cl)OCc1ccc(Cl)cc1
InChIInChI=1S/C15H12Cl2O3/c16-12-7-5-11(6-8-12)9-20-15(18)10-19-14-4-2-1-3-13(14)17/h1-8H,9-10H2
InChIKeyAYFKFGLJEGLDFE-UHFFFAOYSA-N
XLogP4.12
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.16
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

benzyl 2-(2,4,5-trichlorophenoxy)acetate
CID 71395919
[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 2-(2-chlorophenoxy)acetate
CID 8521021
2-(4-chlorophenoxy)-N'-[2-(2-chlorophenoxy)acetyl]acetohydrazide
CID 3372388
(4-nitrophenyl)methyl 2-(2,4-dichlorophenoxy)acetate
CID 1310079
[4-[(2-phenoxyacetyl)oxymethyl]phenyl]methyl 2-phenoxyacetate
CID 2362107
(2-chlorophenyl) 2-(4-chlorophenyl)acetate
CID 3431914
[2-oxo-2-(2,4,6-trichloroanilino)ethyl] 2-(2-chlorophenoxy)acetate
CID 41465862
benzyl 2-[4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenoxy]acetate;4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenol
CID 158160589
2-[2-[2-[2-(2-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethoxy]benzamide
CID 9085660
benzyl 2-[4-(2-aminoethyl)-2-(2-oxo-2-phenylmethoxyethoxy)phenoxy]acetate
CID 134127156
[2-(5-chloro-2-methylanilino)-2-oxoethyl] 2-(2-chlorophenoxy)acetate
CID 2378568
[4-[(2-chlorophenoxy)methyl]phenyl]-phenylmethanone
CID 1265675

Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)methyl 2-(2-chlorophenoxy)acetate?
The IUPAC name of (4-chlorophenyl)methyl 2-(2-chlorophenoxy)acetate (CID 2378588) is (4-chlorophenyl)methyl 2-(2-chlorophenoxy)acetate.
What is the SMILES notation for (4-chlorophenyl)methyl 2-(2-chlorophenoxy)acetate?
The canonical SMILES for (4-chlorophenyl)methyl 2-(2-chlorophenoxy)acetate is O=C(COc1ccccc1Cl)OCc1ccc(Cl)cc1.
What is the InChIKey of (4-chlorophenyl)methyl 2-(2-chlorophenoxy)acetate?
The InChIKey is AYFKFGLJEGLDFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2O3/c16-12-7-5-11(6-8-12)9-20-15(18)10-19-14-4-2-1-3-13(14)17/h1-8H,9-10H2.
What are the key properties of (4-chlorophenyl)methyl 2-(2-chlorophenoxy)acetate?
(4-chlorophenyl)methyl 2-(2-chlorophenoxy)acetate has a molecular weight of 311.16 g/mol, XLogP of 4.12, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)methyl 2-(2-chlorophenoxy)acetate is sourced from PubChem (CID 2378588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).