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Tri-m-cresyl Phosphate - >95.0%(GC), high purity , CAS No.563-04-2
Basic Description
Synonyms | InChI=1/C21H21O4P/c1-16-7-4-10-19(13-16)23-26(22,24-20-11-5-8-17(2)14-20)25-21-12-6-9-18(3)15-21/h4-15H,1-3H3 | Phosphoric acid tri-m-tolyl ester | SY052168 | Tri-m-tolyl phosphate, AldrichCPR | TMTP | EINECS 209-241-8 | P1472 | m-Tolyl phosphate, (C7H7O) |
Specifications & Purity | ≥95%(GC) |
Storage Temp | Store at 2-8°C,Argon charged |
Shipped In | Wet ice |
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Names and Identifiers
Pubchem Sid | 504752089 |
Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504752089 |
IUPAC Name | tris(3-methylphenyl) phosphate |
INCHI | InChI=1S/C21H21O4P/c1-16-7-4-10-19(13-16)23-26(22,24-20-11-5-8-17(2)14-20)25-21-12-6-9-18(3)15-21/h4-15H,1-3H3 |
InChi Key | RMLPZKRPSQVRAB-UHFFFAOYSA-N |
Canonical SMILES | CC1=CC(=CC=C1)OP(=O)(OC2=CC=CC(=C2)C)OC3=CC=CC(=C3)C |
Isomeric SMILES | CC1=CC(=CC=C1)OP(=O)(OC2=CC=CC(=C2)C)OC3=CC=CC(=C3)C |
PubChem CID | 11232 |
UN Number | 2574 |
Packing Group | II |
Molecular Weight | 368.37 |
Reaxy-Rn | 2063138 |
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Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Solubility | Insoluble in water, soluble in toluene, soluble in ether and acetone, slightly soluble in alcohol |
Sensitivity | Moisture sensitive |
Refractive Index | 1.56 |
Boil Point(°C) | 240 °C/3 mmHg |
Melt Point(°C) | 20 °C |
Molecular Weight | 368.400 g/mol |
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XLogP3 | 6.100 |
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Hydrogen Bond Donor Count | 0 |
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Hydrogen Bond Acceptor Count | 4 |
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Rotatable Bond Count | 6 |
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Exact Mass | 368.118 Da |
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Monoisotopic Mass | 368.118 Da |
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Topological Polar Surface Area | 44.800 Ų |
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Heavy Atom Count | 26 |
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Formal Charge | 0 |
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Complexity | 416.000 |
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Isotope Atom Count | 0 |
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Defined Atom Stereocenter Count | 0 |
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Undefined Atom Stereocenter Count | 0 |
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Defined Bond Stereocenter Count | 0 |
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Undefined Bond Stereocenter Count | 0 |
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The total count of all stereochemical bonds | 0 |
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Covalently-Bonded Unit Count | 1 |
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Safety and Hazards(GHS)
Pictogram(s) | GHS09, GHS07 |
Signal | Warning |
Hazard Statements | H411:Toxic to aquatic life with long lasting effects H302:Harmful if swallowed H312:Harmful in contact with skin H400:Very toxic to aquatic life H302+H312:Harmful if swallowed or in contact with skin |
Precautionary Statements | P273:Avoid release to the environment. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of water. P321:Specific treatment (see ... on this label). P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P270:Do not eat, drink or smoke when using this product. P362+P364:Take off contaminated clothing and wash it before reuse. P391:Collect spillage. P330:Rinse mouth. P301+P317:IF SWALLOWED: Get medical help. P317:Get emergency medical help. |
Reaxy-Rn | 2063138 |
Class | 6.1 |
Merck Index | 9763 |
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