Dichlorophenylphosphine

C₆H₅Cl₂PCAS 644-97-3178.98 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₅Cl₂P
Molar mass: 178.98 g/mol
Exact mass: 177.9506 Da
Density: 1.356 g/mL (at 20 °C)
Melting point: −51 °C
Boiling point: 99–101 °C (at 11 Torr)
Flash point: 101.7 °C
logP: 3.10Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 1

Hazards

Danger

H290 May be corrosive to metals63.2% of notifiers
H301 Toxic if swallowed26.9% of notifiers
H302 Harmful if swallowed63.2% of notifiers
H314 Causes severe skin burns and eye damage98.8% of notifiers
H318 Causes serious eye damage62% of notifiers
H335 May cause respiratory irritation32.2% of notifiers

Aggregated from 171 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P234, P260, P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P363, P390, P403+P233, P405, P406, P501

Identifiers

CAS number

644-97-3

SMILES

ClP(Cl)c1ccccc1

InChIKey

IMDXZWRLUZPMDH-UHFFFAOYSA-N

InChI

InChI=1S/C6H5Cl2P/c7-9(8)6-4-2-1-3-5-6/h1-5H

Weigh it out

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

Names and synonyms

11 names

Phosphonous dichloride, P-phenyl-
Phosphonous dichloride, phenyl-
P-Phenylphosphonous dichloride
Phenyldichlorophosphine
Phenylphosphonous dichloride
Phenylphosphine dichloride
Phosphine, dichlorophenyl-
Phenyl phosphorus dichloride
Phenylphosphonous acid dichloride
Phenylphosphinous dichloride
NSC 66478

Reactions

PHENYLDICHLOROPHOSPHINE (Phosphonous dichloride, phenyl-)product

Work with Dichlorophenylphosphine

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

Chlorodiphenylphosphine1079-66-958 % similar Triphenylphosphine603-35-050 % similar 1,4-Bis(diphenylphosphino)benzene1179-06-247 % similar 1,2-Bis(diphenylphosphino)benzene13991-08-743 % similar Tetrakis(triphenylphosphine)palladium14221-01-343 % similar Tetrakis(triphenylphosphine)platinum14221-02-443 % similar Methyldiphenylphosphine1486-28-843 % similar 1,2-Bis(diphenylphosphino)ethane1663-45-243 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia