Distearyl phosphate
Basic information
- CAS
3037-89-6- Standard SMILES
CCCCCCCCCCCCCCCCCCOP(=O)(O)OCCCCCCCCCCCCCCCCCC- InChIKey
FRXGWNKDEMTFPL-UHFFFAOYSA-N- Molecular formula
- C36H75O4P
- Average molar mass
- 603 g/mol
- Monoisotopic mass
- 602.54029751
Names & identifiers
- Preferred name
- Distearyl phosphate
- IUPAC
- dioctadecyl hydrogen phosphate
- English name
- DI-N-OCTADECYL PHOSPHATE
- Molecular formula
- C36H75O4P
- Molecular weight
- 602.95
Names & synonyms
Dioctadecyl hydrogen phosphateDistearyl phosphateDioctadecyl phosphateDistearyl acid phosphatedi-n-Octadecyl phosphateDioctadecyl orthophosphatePhosphoric acid, dioctadecyl esterPhosphated stearyl alcoholUNII-47N7586GSW47N7586GSWNSC 2681NSC-2681
Show more names
DistearylacidphosphatePhosphatedstearylalcoholdistearyl hydrogen phosphatePhosphoricacid,dioctadecylesterPhosphoric acid bisoctadecyl esterPhosphoric acid hydrogen distearyl ester
EINECS 221-237-8DTXSID90863065MONOHYDROGEN DISTEARYL PHOSPHATEDIOCTADECYL MONOHYDROGEN PHOSPHATERefChem:135131DTXCID401977213037-89-6DI-N-OCTADECYLPHOSPHATE
Database identifiers
- CAS
3037-89-6- PubChem CID
- 76433
- DTXSID
DTXSID90863065- UNII
- 47N7586GSW
- EC Number
- 221-237-8
- Nikkaji
- J143.903K
Properties
Computed structural properties
- XLogP
- 16.6
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 36
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 486
Physicochemical properties
- Melting point
- 74 · 74-76 °C(Solv: ethanol (64-17-5))
- Boiling point
- 642.9 · 642.9±38.0 °C(Predicted)
- Density
- 0.917 · 0.917±0.06 g/cm3(Predicted)
- pka
- 1.5 · 1.50±0.50(Predicted)
- FDA UNII
- 47 N7586GSW · 47N7586GSW
- EPA Substance Registry System
- Distearyl phosphate (3037-89-6)
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314
- Precautionary statements
- 260 · P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
- 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.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 14.3% (1 of 7) of reports.
Danger
H314 (85.7%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 7 reports by companies from 2 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory InformationChemical: Phosphoric acid, dioctadecyl ester
Hazard Classes and CategoriesSkin Corr. 1B (85.7%)
Safety data
- tsca
- TSCA listed
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- Hazard statements
- H314
- Precautionary statements
- P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPhosphoric acid, dioctadecyl ester: ACTIVE
Related reactions
1 records
Compound notes
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