2,4-Di-tert-amylphenol - CAS 120-95-6
Catalog: |
BB005003 |
Product Name: |
2,4-Di-tert-amylphenol |
CAS: |
120-95-6 |
Synonyms: |
Phenol, 2,4-bis(1,1-dimethylpropyl)-; 2,4-Bis(1,1-dimethylpropyl)phenol; Phenol, 2,4-di-tert-pentyl-; 2,4-Bis(tert-pentyl)phenol; 2,4-Di(1,1-dimethylpropyl)phenol; 2,4-Di-tert-pentylphenol; NSC 158351 |
IUPAC Name: | 2,4-bis(2-methylbutan-2-yl)phenol |
Molecular Weight: | 234.38 |
Molecular Formula: | C16H26O |
Canonical SMILES: | CCC(C)(C)C1=CC(=C(C=C1)O)C(C)(C)CC |
InChI: | InChI=1S/C16H26O/c1-7-15(3,4)12-9-10-14(17)13(11-12)16(5,6)8-2/h9-11,17H,7-8H2,1-6H3 |
InChI Key: | WMVJWKURWRGJCI-UHFFFAOYSA-N |
Boiling Point: | 256°C |
Melting Point: | 27°C |
Purity: | ≥95% |
Density: | 0.921±0.06 g/cm3 |
Appearance: | White or Colorless to Almost White or Almost Colorless Powder to Lump to Clear Liquid |
Storage: | Store at 2-8°C |
MDL: | MFCD00041929 |
LogP: | 4.76740 |
Vapor Pressure: | 0.0000841 [mmHg] |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P260, P264, P270, P273, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P330, P332+P313, P337+P313, P362, P363, P391, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
AU-2021102623-A4 | Method for rapidly screening substances of very high concern (svhcs) in surface water and soil | 20210528 |
CN-112679979-A | Preparation method of benzotriazole ultraviolet absorber intermediate azo dye | 20201229 |
KR-102242171-B1 | Self emission type photosensitive resin composition, and display device comprising color conversion layer prepared thereby | 20201217 |
KR-20210004913-A | Self emission type photosensitive resin composition, and display device comprising color conversion layer prepared thereby | 20201217 |
CN-111689853-A | Layered bisphenol acrylate antioxidant and preparation method thereof | 20200628 |
PMID | Publication Date | Title | Journal |
11875820 | 20011201 | [Determination of 2,4,6-tri-tert-butylphenol and related compounds in foods] | Shokuhin eiseigaku zasshi. Journal of the Food Hygienic Society of Japan |
Complexity: | 242 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 234.198365449 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 234.198365449 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 20.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 6 |
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