chempirical

1-Ethylcyclopentanol

C7H14OCAS 1462-96-0114.19 g/mol

Open in Covalent MOL file
HO
Alcohol

Properties

Molecular formula
C7H14O
Molar mass
114.19 g/mol
Exact mass
114.1045 Da
logP
1.70Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
1462-96-0
SMILES
CCC1(CCCC1)O
InChIKey
LPCWIFPJLFCXRS-UHFFFAOYSA-N
InChI
InChI=1S/C7H14O/c1-2-7(8)5-3-4-6-7/h8H,2-6H2,1H3

Weigh it out

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

Work with 1-Ethylcyclopentanol

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

1-Ethylcyclohexanol1940-18-794 % similar 3-Ethyl-3-hexanol597-76-257 % similar 3-Methyl-3-octanol5340-36-341 % similar 3-Methyl-3-nonanol21078-72-839 % similar 1-(2-Propen-1-yl)cyclohexanol1123-34-838 % similar 1-Methylcyclopentanol1462-03-936 % similar tert-Amyl alcohol75-85-436 % similar 3-Methyl-3-pentanol77-74-736 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Cyclohexylmethanol100-49-2 3-Heptanone106-35-4 5-Methyl-2-hexanone110-12-3 2-Heptanone110-43-0 Heptanal111-71-7 4-Heptanone123-19-3 2,3-Dimethylpentanal32749-94-3 trans-2-Hepten-1-ol33467-76-4

Elsewhere

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