Tripropyl phosphate
Properties
- Molecular formula
- C9H21O4P
- Molar mass
- 224.24 g/mol
- Exact mass
- 224.1177 Da
- Density
- 0.9884 g/mL (at 40 °C)
- Boiling point
- 252 °C
- logP
- 3.37Crippen estimate
- Polar surface area
- 44.8 Ų
- H-bond donors / acceptors
- 0 / 4
- Rotatable bonds
- 9
Hazards
Warning
- H302 Harmful if swallowed100% of notifiers
- H312 Harmful in contact with skin95.1% of notifiers
- H315 Causes skin irritation97.6% of notifiers
- H319 Causes serious eye irritation97.6% of notifiers
- H332 Harmful if inhaled95.1% of notifiers
- H335 May cause respiratory irritation95.1% of notifiers
Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
513-08-6SMILES
CCCOP(=O)(OCCC)OCCCInChIKey
RXPQRKFMDQNODS-UHFFFAOYSA-NInChI
InChI=1S/C9H21O4P/c1-4-7-11-14(10,12-8-5-2)13-9-6-3/h4-9H2,1-3H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
3 names
- Phosphoric acid, tripropyl ester
- Propyl phosphate ((PrO)3PO)
- Tri-n-propyl phosphate
Work with Tripropyl phosphate
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
Tributyl phosphate126-73-871 % similar
Tris(2-butoxyethyl) phosphate78-51-363 % similar
Triethyl phosphate78-40-052 % similar
Tris(2-chloroethyl) phosphate115-96-848 % similar
Triisobutyl phosphate126-71-646 % similar
Tris(2-ethylhexyl) phosphate78-42-243 % similar
Tetraethyl pyrophosphate107-49-342 % similar
Tris(2-chloropropyl) phosphate6145-73-941 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.