(+)-Fenchone

C10H16OCAS 4695-62-9152.24 g/mol

Open in Covalent MOL file
O
Ketone

Properties

Molecular formula
C10H16O
Molar mass
152.24 g/mol
Exact mass
152.1201 Da
Density
1.1995 g/mL (at 25 °C)
Melting point
6.1 °C
Boiling point
192 °C
logP
2.40Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0
Stereocentres
S, Rin SMILES atom order

Hazards

Not classified as hazardous under GHS by 288 ECHA notifiers. Aggregated from 288 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Identifiers

CAS number
4695-62-9
SMILES
CC1(C)C(=O)[C@@]2(C)CC[C@@H]1C2
InChIKey
LHXDLQBQYFFVNW-XCBNKYQSSA-N
InChI
InChI=1S/C10H16O/c1-9(2)7-4-5-10(3,6-7)8(9)11/h7H,4-6H2,1-3H3/t7-,10+/m1/s1

Weigh it out

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

Names and synonyms

9 names
  • Bicyclo[2.2.1]heptan-2-one, 1,3,3-trimethyl-, (1S,4R)-
  • 2-Norbornanone, 1,3,3-trimethyl-, (1S,4R)-(+)-
  • Bicyclo[2.2.1]heptan-2-one, 1,3,3-trimethyl-, (1S)-
  • (1S,4R)-1,3,3-Trimethylbicyclo[2.2.1]heptan-2-one
  • D(+)-Fenchone
  • D-Fenchone
  • (1S)-Fenchone
  • (S)-(+)-Fenchone
  • (S)-Fenchone

Work with (+)-Fenchone

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

(-)-Fenchone7787-20-4Enantiomer

Similar compounds

(-)-Camphor464-48-235 % similar (+)-Camphor464-49-335 % similar Camphor76-22-235 % similar (-)-Isolongifolene1135-66-634 % similar 2,2-Dimethylcyclopropanecarboxamide1759-55-331 % similar 2,2-Dimethyl cyclopropyl carboxylic acid75885-59-531 % similar 1-(1-Methylcyclopropyl)ethanone1567-75-531 % similar (S)-(+)-Ketopinic acid40724-67-231 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

α-Pinene oxide1686-14-2 (-)-Perillyl alcohol18457-55-1 (-)-Myrtenol19894-97-4 (-)-cis-Carveol2102-59-2 (±)-Camphor21368-68-3 (1S,4R)-1-Methyl-4-(1-methylethenyl)-2-cyclohexen-1-ol22972-51-6 2,4-Decadienal2363-88-4 (E,E)-2,4-Decadienal25152-84-5

Elsewhere

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