Dibromotriphenylphosphorane

C₁₈H₁₅Br₂PCAS 1034-39-5422.10 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₈H₁₅Br₂P
Molar mass: 422.10 g/mol
Exact mass: 419.9278 Da
logP: 5.14Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 3

Hazards

Danger

H314 Causes severe skin burns and eye damage100% of notifiers
H318 Causes serious eye damage81.2% of notifiers

Aggregated from 48 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, P501

Identifiers

CAS number

1034-39-5

SMILES

BrP(Br)(c1ccccc1)(c1ccccc1)c1ccccc1

InChIKey

OCXGTPDKNBIOTF-UHFFFAOYSA-N

InChI

InChI=1S/C18H15Br2P/c19-21(20,16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H

Weigh it out

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

Names and synonyms

5 names

Phosphorane, dibromotriphenyl-
Triphenyldibromophosphorane
Triphenylphosphine dibromide
NSC 87871
Pph3br2

Work with Dibromotriphenylphosphorane

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

Triphenylphosphine dichloride2526-64-943 % similar Iodomethyltriphenylphosphorane20667-19-038 % similar Bromobenzene108-86-135 % similar Biphenyl92-52-433 % similar para-Quaterphenyl135-70-632 % similar Azulene275-51-432 % similar P-Quinquephenyl3073-05-032 % similar 1,1′:4′,1′′:4′′,1′′′:4′′′,1′′′′:4′′′′,1′′′′′-Sexiphenyl4499-83-632 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook