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Ethyl 2-(4-chlorophenyl)cyclopropanecarboxylate

HCID 533756
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(=O)C1CC1c1ccc(Cl)cc1
InChIKey
MBJPATUIODMIKJ-UHFFFAOYSA-N
Molecular formula
C12H13ClO2
Average molar mass
224.68 g/mol
Monoisotopic mass
224.0604073

Names & identifiers

Preferred name
Ethyl 2-(4-chlorophenyl)cyclopropanecarboxylate
IUPAC
ethyl 2-(4-chlorophenyl)cyclopropane-1-carboxylate

Names & synonyms

Ethyl 2-(4-chlorophenyl)cyclopropanecarboxylate91393-54-3ethyl 2-(4-chlorophenyl)cyclopropane-1-carboxylateMFCD034194432-(4-Chloro-phenyl)-cyclopropanecarboxylic acid ethyl esterCyclopropanecarboxylic acid, 2-(4-chlorophenyl)-, ethyl esterMFCD30347818SCHEMBL1570974SBB020382AKOS000307922SY078300DB-307912
Show more names
2-p-chlorophenyl-1-ethoxycarbonylcyclopropaneST45092405Ethyl2-(4-chlorophenyl)cyclopropanecarboxylateEN300-228333Ethyl-2-(4-chlorophenyl)cyclopropanecarboxylateG78598Ethyl 2-(4-chlorophenyl)-cyclopropanecarboxylateEthyl 2-(4-chlorophenyl)cyclopropanecarboxylate #

Database identifiers

PubChem CID
533756
Nikkaji
J1.688.302F

Properties

Computed structural propertiesFilling in

XLogP
3
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
15
Formal charge
0
Complexity
234

Related reactions

8 records
New reaction record
HRID 184771 reaction equation
HRID 184771As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 510664 reaction equation
HRID 510664As productuspto-grants-2015_08
HRID 510665 reaction equation
HRID 510665As reactantuspto-grants-2015_08
HRID 1021431 reaction equation
HRID 1021431As productuspto-grants-2014_05
HRID 1021432 reaction equation
HRID 1021432As reactantuspto-grants-2014_05
HRID 1048059 reaction equation
HRID 1048059As productuspto-grants-2013_10
HRID 1048060 reaction equation
HRID 1048060As reactantuspto-grants-2013_10
HRID 2159929 reaction equation
HRID 2159929As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes