1,1-Diphenylpentane

C₁₇H₂₀CAS 1726-12-1224.35 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₇H₂₀
Molar mass: 224.35 g/mol
Exact mass: 224.1565 Da
logP: 5.01Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 5

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H400 Very toxic to aquatic life100% of notifiers
H410 Very toxic to aquatic life with long lasting effects100% of notifiers

Aggregated from 38 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P273, P301+P317, P330, P391, P501

Identifiers

CAS number

1726-12-1

SMILES

CCCCC(C1=CC=CC=C1)C2=CC=CC=C2

InChIKey

GSGNVNZDHCKRGI-UHFFFAOYSA-N

InChI

InChI=1S/C17H20/c1-2-3-14-17(15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-13,17H,2-3,14H2,1H3

Weigh it out

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

Reactions

1,1-DIPHENYLPENTANE (Pentane, 1,1-diphenyl-)product

Work with 1,1-Diphenylpentane

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

1,1′-Hexylidenebis[benzene]1530-04-788 % similar 1-Phenyl-1-pentanol583-03-962 % similar 1,1-Diphenylpropane1530-03-654 % similar n-Butylbenzene104-51-850 % similar γ-Phenylbenzenepropanol20017-67-850 % similar 3,3-Diphenylpropyl bromide20017-68-950 % similar N-Methyl-γ-phenylbenzenepropanamine28075-29-850 % similar 3,3-Diphenylpropylamine5586-73-250 % similar

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

Same formula

4-Pentyl-1,1′-biphenyl7116-96-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook