Ethyl 1-acetylcyclopropanecarboxylate

C8H12O3CAS 32933-03-2156.18 g/mol

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OOO
EsterKetone

Properties

Molecular formula
C8H12O3
Molar mass
156.18 g/mol
Exact mass
156.0786 Da
logP
0.92Crippen estimate
Polar surface area
43.4 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
3

Hazards

Warning
Irritant (GHS07)

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, P501

Identifiers

CAS number
32933-03-2
SMILES
CCOC(=O)C1(CC1)C(=O)C
InChIKey
DISZFIFAESWGBI-UHFFFAOYSA-N
InChI
InChI=1S/C8H12O3/c1-3-11-7(10)8(4-5-8)6(2)9/h3-5H2,1-2H3

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Names and synonyms

1 names
  • Ethyl 1-acetylcyclopropane-1-carboxylate

Work with Ethyl 1-acetylcyclopropanecarboxylate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Diethyl cyclopropane-1,1-dicarboxylate1559-02-073 % similar Diethyl 1,1-cyclobutanedicarboxylate3779-29-162 % similar 1,3-Diethyl 2,2-dipropylpropanedioate6065-63-060 % similar Ethyl 2,2-difluoroacetoacetate2266-48-059 % similar Diethylmalonic acid diethyl ester77-25-859 % similar Diethyl dibutylmalonate596-75-856 % similar Diethyl bis(hydroxymethyl)malonate20605-01-055 % similar Ethyl 1-methylcyclopropanecarboxylate71441-76-452 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Oxolan-2-yl 2-methylprop-2-enoate15895-80-4 Tetrahydrofurfuryl acrylate2399-48-6 Ethyl 3-cyclopropyl-3-oxopropanoate24922-02-9 3,4-Epoxycyclohexanecarboxylate methyl ester41088-52-2 Methyl 2-cyclohexanonecarboxylate41302-34-5 1,4-Dioxaspiro[4.5]decan-8-one4746-97-8 Methyl 7-hydroxyhept-5-ynoate50781-91-4 Ethyl 3-oxocyclopentane-1-carboxylate5400-79-3

Elsewhere

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