3a,4,5,6,7,7a-Hexahydro-1H-4,7-methanoinden-6-yl propionate

C₁₃H₁₈O₂CAS 17511-60-3206.28 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₃H₁₈O₂
Molar mass: 206.28 g/mol
Exact mass: 206.1307 Da
logP: 2.54Crippen estimate
Polar surface area: 26.3 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 2

Identifiers

CAS number

17511-60-3

SMILES

CCC(=O)OC1CC2CC1C1CC=CC21

InChIKey

BLBJUGKATXCWET-UHFFFAOYSA-N

InChI

InChI=1S/C13H18O2/c1-2-13(14)15-12-7-8-6-11(12)10-5-3-4-9(8)10/h3-4,8-12H,2,5-7H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

7 names

4,7-Methano-1H-inden-6-ol, 3A,4,5,6,7,7A-hexahydro-, 6-propanoate
4,7-Methanoinden-6-ol, 3a,4,5,6,7,7a-hexahydro-, propionate
4,7-Methano-1H-inden-6-ol, 3a,4,5,6,7,7a-hexahydro-, propanoate
Cyclaprop
Florocyclene
Greenyl propionate
Herbyl propionate

Work with 3a,4,5,6,7,7a-Hexahydro-1H-4,7-methanoinden-6-yl propionate

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

Same formula

Isoamyl phenylacetate102-19-2 Phenylethyl isovalerate140-26-1 1-(4-Hydroxyphenyl)-1-heptanone14392-72-4 Ibuprofen15687-27-1 4-Hexylbenzoic acid21643-38-9 Phenylethyl 2-methylbutyrate24817-51-4 P-tert-Butylphenyl glycidyl ether3101-60-8 Methyl P-tert-butylphenylacetate3549-23-3

Elsewhere

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