Phosphoric acid, 3-methylphenyl bis(4-methylphenyl) ester
Basic information
- CAS
136868-91-2- Standard SMILES
Cc1ccc(OP(=O)(Oc2ccc(C)cc2)Oc2cccc(C)c2)cc1- InChIKey
YSLTUIZNWYDWRT-UHFFFAOYSA-N- Molecular formula
- C21H21O4P
- Average molar mass
- 368.4 g/mol
- Monoisotopic mass
- 368.11774614
Names & identifiers
- Preferred name
- Phosphoric acid, 3-methylphenyl bis(4-methylphenyl) ester
- IUPAC
- (3-methylphenyl) bis(4-methylphenyl) phosphate
- English name
- Bis(p-cresyl) m-Cresyl Phosphate
- Molecular formula
- C21H21O4P
- Molecular weight
- 368.362801
Names & synonyms
136868-91-2RefChem:862445Phosphoric acid, 3-methylphenyl bis(4-methylphenyl) ester807-335-9Bis(p-cresyl) m-Cresyl PhosphateBis(p-cresyl)m-CresylPhosphateSCHEMBL18738740Phosphoric acid bis(4-methylphenyl)(3-methylphenyl) esterPhosphoric Acid 3-Methylphenyl Bis(4-methylphenyl) Ester
Database identifiers
- CAS
136868-91-2- PubChem CID
- 11979554
- EC Number
- 807-335-9
- Nikkaji
- J1.161.871E
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 439
Experimental & physicochemical properties
Chemical ClassesOrganophosphate
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 100% (37 of 37) of all reports.
Not Classified
Aggregated GHS information provided per 37 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesNot Classified
Chemistry & industry
Applications
UsesBis(p-cresyl) m-Cresyl Phosphate is an isomer of Tricresyl phosphate (TCP) which is used as an anti-wear additive in aircraft turbine engine oil.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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