Ethyl cyclohexylideneacetate

C10H16O2CAS 1552-92-7168.24 g/mol

Open in Covalent MOL file
OO
AlkeneEster

Properties

Molecular formula
C10H16O2
Molar mass
168.24 g/mol
Exact mass
168.1150 Da
logP
2.44Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

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

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
1552-92-7
SMILES
CCOC(=O)C=C1CCCCC1
InChIKey
MCWDXHYYYNGYGK-UHFFFAOYSA-N
InChI
InChI=1S/C10H16O2/c1-2-12-10(11)8-9-6-4-3-5-7-9/h8H,2-7H2,1H3

Weigh it out

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Names and synonyms

15 names · show all
  • Ethyl 2-cyclohexylideneacetate
  • Acetic acid, 2-cyclohexylidene-, ethyl ester
  • Ethyl 2-cyclohexylidenacetate
  • Cyclohexylideneacetic acid ethyl ester
  • Acetic acid, cyclohexylidene-, ethyl ester
  • 2-Cyclohexylidene-acetic Acid Ethyl Ester
  • Ethoxycarbonylmethylenecyclohexane
  • .DELTA.1,.alpha.-Cyclohexaneacetic acid, ethyl ester
  • Cyclohexylideneacetic acid ethyl
  • 2-Cyclohexylideneacetic acid ethyl ester
  • .DELTA.1, ethyl ester
  • Ethyl 1-cyclohexene-1-acetate
  • Cyclohexylidenessigsaureathylester
  • Delta1,alpha-Cyclohexaneacetic Acid Ethyl Ester
  • Delta1,alpha-Cyclohexaneacetic acid, ethyl ester

Reactions

Work with Ethyl cyclohexylideneacetate

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

Ethyl 2-(oxetan-3-ylidene)acetate922500-91-263 % similar Ethyl 3,3-diethoxy-2-propenoate32002-24-759 % similar Ethyl 3,3-dimethylacrylate638-10-857 % similar Diethyl maleate141-05-954 % similar Diethyl fumarate623-91-654 % similar Ethyl 3-aminocrotonate626-34-652 % similar Ethyl β-aminocrotonate7318-00-552 % similar tert-Butyl 4-(2-ethoxy-2-oxoethylidene)piperidine-1-carboxylate135716-08-451 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Cyclohexyl methacrylate101-43-9 Ethyl 2-octynoate10519-20-7 Methyl 2-nonynoate111-80-8 1-Methylcyclopentyl methacrylate178889-45-7 (1S,2S,5S)-2-Hydroxy-2,6,6-trimethylbicyclo[3.1.1]heptan-3-one1845-25-6 (1R,2R,5R)-(+)-2-Hydroxy-3-pinanone24047-72-1 2-Propenoic acid 1-ethylcyclopentyl ester326925-69-3 Geranic acid459-80-3

Elsewhere

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