chempirical

1,2,3,4,5,6,7,8-Octahydrophenanthrene

C14H18CAS 5325-97-3186.30 g/mol

Open in Covalent MOL file

Properties

Molecular formula
C14H18
Molar mass
186.30 g/mol
Exact mass
186.1409 Da
Density
1.026 g/mL (at 20 °C)
Melting point
16.7 °C
Boiling point
295 °C
logP
3.44Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Identifiers

CAS number
5325-97-3
SMILES
c1cc2c(c3c1CCCC3)CCCC2
InChIKey
YSZLFGZFQTTZIQ-UHFFFAOYSA-N
InChI
InChI=1S/C14H18/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13/h9-10H,1-8H2

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

Names and synonyms

3 names
  • Phenanthrene, 1,2,3,4,5,6,7,8-octahydro-
  • Sym-Octahydrophenanthrene
  • NSC 240

Work with 1,2,3,4,5,6,7,8-Octahydrophenanthrene

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

Similar compounds

Tetralin119-64-250 % similar 5,6,7,8-Tetrahydro-1-naphthylamine2217-41-650 % similar Dodecahydrotriphenylene1610-39-547 % similar 4-Indanol1641-41-444 % similar 4-Aminoindane32202-61-244 % similar Indane496-11-742 % similar 5,6,7,8-Tetrahydro-2-naphthol1125-78-642 % similar 5,6,7,8-Tetrahydro-1-naphthalenecarboxylic acid4242-18-640 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook