Phenylphosphonic dichloride
Properties
- Molecular formula
- C6H5Cl2OP
- Molar mass
- 194.98 g/mol
- Exact mass
- 193.9455 Da
- Density
- 1.197 g/mL (at 25 °C)
- Melting point
- 1 °C
- Boiling point
- 258 °C
- logP
- 2.98Crippen estimate
- Polar surface area
- 17.1 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 1
Hazards
Danger
- H290 May be corrosive to metals44% of notifiers
- H302 Harmful if swallowed55.2% of notifiers
- H314 Causes severe skin burns and eye damage98.9% of notifiers
- H318 Causes serious eye damage41% of notifiers
- H335 May cause respiratory irritation48.1% of notifiers
Aggregated from 268 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+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
824-72-6SMILES
O=P(Cl)(Cl)c1ccccc1InChIKey
IBDMRHDXAQZJAP-UHFFFAOYSA-NInChI
InChI=1S/C6H5Cl2OP/c7-10(8,9)6-4-2-1-3-5-6/h1-5HWeigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
11 names
- Phosphonic dichloride, P-phenyl-
- Phosphonic dichloride, phenyl-
- P-Phenylphosphonic dichloride
- Benzenephosphonyl chloride
- Phenylphosphonic acid dichloride
- Phenylphosphonyl dichloride
- Phenyldichlorophosphine oxide
- Benzenephosphonic dichloride
- Dichlorophenylphosphine oxide
- Phenylphosphoryl dichloride
- NSC 66477
Work with Phenylphosphonic dichloride
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
Diphenylphosphinic chloride1499-21-457 % similar
Triphenylphosphine oxide791-28-650 % similar
Phenylphosphonic acid1571-33-144 % similar
Diphenylphosphinic acid1707-03-544 % similar
Methyldiphenylphosphine oxide2129-89-744 % similar
P-Phenylphosphonothioic dichloride3497-00-544 % similar
Ethyldiphenylphosphine oxide1733-57-939 % similar
Dimethyl P-phenylphosphonate2240-41-739 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.