(3-Chloro-4-cyano-phenoxy)-acetic acid ethyl ester

HCID 69253333
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Basic information

Standard SMILES
CCOC(=O)COc1ccc(C#N)c(Cl)c1
InChIKey
QOGSOZHIWCLNAS-UHFFFAOYSA-N
Molecular formula
C11H10ClNO3
Average molar mass
239.65 g/mol
Monoisotopic mass
239.0349209

Names & identifiers

Preferred name
(3-Chloro-4-cyano-phenoxy)-acetic acid ethyl ester
IUPAC
ethyl 2-(3-chloro-4-cyanophenoxy)acetate

Names & synonyms

SCHEMBL4950133QOGSOZHIWCLNAS-UHFFFAOYSA-N(3-chloro-4-cyano-phenoxy)-acetic acid ethyl ester

Database identifiers

PubChem CID
69253333

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
59.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
16

Related reactions

2 records
New reaction record

Compound notes

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