Methyl 2-(2-chloroethoxy)benzoate

HCID 9837283

Notes Reactions

Substructure search Find similar structures

Basic information

Standard SMILES: COC(=O)c1ccccc1OCCCl
InChIKey: GCCYBNZBCGRHRR-UHFFFAOYSA-N
Molecular formula: C10H11ClO3
Average molar mass: 214.64 g/mol

Names & identifiers

Preferred name: Methyl 2-(2-chloroethoxy)benzoate
IUPAC: methyl 2-(2-chloroethoxy)benzoate

Names & synonyms

Methyl 2-(2-chloroethoxy)benzoate2-(2-CHLOROETHOXY)BENZOIC ACID METHYL ESTERSCHEMBL4051431GCCYBNZBCGRHRR-UHFFFAOYSA-NAKOS0109940232-(2-chloroethoxy)-benzoic acid methyl ester2-(2-chloro-ethoxy)-benzoic acid methyl ester

Database identifiers

PubChem CID: 9837283

Properties

Computed structural properties

XLogP: 2.6
Topological polar surface area: 35.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 5
Heavy atoms: 14
Formal charge: 0
Complexity: 184

Related reactions

28 records

New reaction record

HRID 86581As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 141331As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)

HRID 212443As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)

HRID 457778As productuspto-grants-2007_03

HRID 457779As reactantuspto-grants-2007_03

HRID 457784As reactantuspto-grants-2007_03

HRID 457786As reactantuspto-grants-2007_03

HRID 457788As reactantuspto-grants-2007_03

Compound notes

Loading…