Phosphine oxide, tris(chloromethyl)-
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Basic information
- CAS
4851-89-2- Standard SMILES
O=P(CCl)(CCl)CCl- InChIKey
GGECNORVQSLCLI-UHFFFAOYSA-N- Molecular formula
- C3H6Cl3OP
- Average molar mass
- 195.41 g/mol
- Monoisotopic mass
- 193.922185
Names & identifiers
- Preferred name
- Phosphine oxide, tris(chloromethyl)-
- IUPAC
- bis(chloromethyl)phosphoryl-chloromethane
- English name
- Tris(chloromethyl)phosphine oxide
- Molecular formula
- C3H6Cl3OP
- Molecular weight
- 195.41
Names & synonyms
Tris(chloromethyl)phosphine oxidePhosphine oxide, tris(chloromethyl)-4851-89-2NSC 222442DTXSID8063624Phosphine oxide, tris[chloromethyl]-RefChem:173524DTXCID5040627Tri(chloromethyl)phosphine oxideNSC-222442bis(chloromethyl)phosphoryl-chloromethane[bis(chloromethyl)phosphoryl](chloro)methane
Show more names
BL5AGC2ESBSCHEMBL258515GGECNORVQSLCLI-UHFFFAOYSA-NNSC222442Tris(chloromethyl)(oxo)-lambda~5~-phosphane
Database identifiers
- CAS
4851-89-2- PubChem CID
- 78565
- DTXSID
DTXSID8063624- UNII
- BL5AGC2ESB
- Nikkaji
- J421.742J
Properties
Computed structural propertiesFilling in
- XLogP
- 1.4
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 85.7
Experimental & physicochemical properties
SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy
Physicochemical properties
- Melting point
- 100.5 °C · 100.5 °C
- Boiling point
- 351.6 · 351.6±37.0 °C(Predicted)
- Density
- 1.433 · 1.433±0.06 g/cm3(Predicted)
- FDA UNII
- 5 AGC2ESB · BL5AGC2ESB
- EPA Substance Registry System
- Phosphine oxide, tris(chloromethyl)- (4851-89-2)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPhosphine oxide, tris(chloromethyl)-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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