1,3-Bis(phenylphosphino)propane

C₁₅H₁₈P₂CAS 28240-66-6260.26 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₅H₁₈P₂
Molar mass: 260.26 g/mol
Exact mass: 260.0884 Da
logP: 3.38Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 6

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

28240-66-6

SMILES

C1=CC=C(C=C1)PCCCPC2=CC=CC=C2

InChIKey

AVNRJUHUOZDFKS-UHFFFAOYSA-N

InChI

InChI=1S/C15H18P2/c1-3-8-14(9-4-1)16-12-7-13-17-15-10-5-2-6-11-15/h1-6,8-11,16-17H,7,12-13H2

Weigh it out

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

Work with 1,3-Bis(phenylphosphino)propane

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

Diphenylphosphine829-85-645 % similar 1,3-Diphenylpropane1081-75-038 % similar Bibenzyl103-29-733 % similar Diphenylmethane101-81-532 % similar Diphenylamine122-39-432 % similar n-Butylbenzene104-51-831 % similar 1-Chloro-3-phenylpropane104-52-931 % similar Benzenepropanol122-97-431 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook