Determine the necessary mass, volume, or concentration for preparing a solution.
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Synonyms | Phosphoric acid, tris(4-methylphenyl) ester | 4-methylphenyl di4-methylphenyl phosphate | Tritolyl phosphate, mixture of isomers | NCGC00260672-01 | P-TOLYL PHOSPHATE (C7H7O)3PO | DSSTox_CID_1391 | Phosphoric acid, tri-p-tolyl ester | 5149JKD098 | Tricres |
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Specifications & Purity | ≥98% |
Shipped In | Normal |
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Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
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Pubchem Sid | 488180088 |
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Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488180088 |
IUPAC Name | tris(4-methylphenyl) phosphate |
INCHI | InChI=1S/C21H21O4P/c1-16-4-10-19(11-5-16)23-26(22,24-20-12-6-17(2)7-13-20)25-21-14-8-18(3)9-15-21/h4-15H,1-3H3 |
InChi Key | BOSMZFBHAYFUBJ-UHFFFAOYSA-N |
Canonical SMILES | CC1=CC=C(C=C1)OP(=O)(OC2=CC=C(C=C2)C)OC3=CC=C(C=C3)C |
Isomeric SMILES | CC1=CC=C(C=C1)OP(=O)(OC2=CC=C(C=C2)C)OC3=CC=C(C=C3)C |
RTECS | TC9330000 |
PubChem CID | 6529 |
UN Number | 3082 |
Packing Group | III |
Molecular Weight | 368.37 |
Beilstein | 6(4)2130 |
Reaxy-Rn | 1891089 |
Find and download the COA for your product by matching the lot number on the packaging.
Lot Number | Certificate Type | Date | Item |
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Certificate of Analysis | Jan 11, 2023 | T162667 |
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Certificate of Analysis | Jan 11, 2023 | T162667 |
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Certificate of Analysis | Jan 11, 2023 | T162667 |
Solubility | Insoluble in water; Soluble in Alcohol,Benzene,Ether,Chloroform |
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Boil Point(°C) | 430°C(lit.) |
Melt Point(°C) | 77 °C |
Molecular Weight | 368.400 g/mol |
XLogP3 | 5.100 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 6 |
Exact Mass | 368.118 Da |
Monoisotopic Mass | 368.118 Da |
Topological Polar Surface Area | 44.800 Ų |
Heavy Atom Count | 26 |
Formal Charge | 0 |
Complexity | 392.000 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
The total count of all stereochemical bonds | 0 |
Covalently-Bonded Unit Count | 1 |
Pictogram(s) | GHS09, GHS07 |
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Signal | Warning |
Hazard Statements |
H411: Toxic to aquatic life with long lasting effects H302: Harmful if swallowed H312: Harmful 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. |
RTECS | TC9330000 |
Reaxy-Rn | 1891089 |
Class | 9 |
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