2-(1-Adamantyl)-4-methylphenol - CAS 41031-50-9
Catalog: |
BB024756 |
Product Name: |
2-(1-Adamantyl)-4-methylphenol |
CAS: |
41031-50-9 |
Synonyms: |
2-(1-adamantyl)-4-methylphenol |
IUPAC Name: | 2-(1-adamantyl)-4-methylphenol |
Description: | 2-(1-Adamantyl)-4-methylphenol (CAS# 41031-50-9) is a useful research chemical. |
Molecular Weight: | 242.36 |
Molecular Formula: | C17H22O |
Canonical SMILES: | CC1=CC(=C(C=C1)O)C23CC4CC(C2)CC(C4)C3 |
InChI: | InChI=1S/C17H22O/c1-11-2-3-16(18)15(4-11)17-8-12-5-13(9-17)7-14(6-12)10-17/h2-4,12-14,18H,5-10H2,1H3 |
InChI Key: | XHLJIHBDAJFXBE-UHFFFAOYSA-N |
Boiling Point: | 359.9 °C at 760 mmHg |
Density: | 1.137 g/cm3 |
Appearance: | White powder, crystals or crystalline powder and/or chunks |
MDL: | MFCD00168147 |
LogP: | 4.16840 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021162746-A1 | Propylene polymers obtained using transition metal bis(phenolate) catalyst complexes and homogeneous process for production thereof | 20200211 |
US-2020255553-A1 | Transition Metal Bis(Phenolate) Complexes and Their Use as Catalysts for Olefin Polymerization | 20190212 |
WO-2020167821-A1 | Transition metal bis(phenolate) complexes and their use as catalysts for olefin polymerization | 20190212 |
KR-20210118204-A | Transition metal bis(phenolate) complexes and their use as catalysts for olefin polymerization | 20190212 |
CN-105348415-B | A kind of salicylide amido rare-earth metal catalyst, preparation method and application | 20151022 |
PMID | Publication Date | Title | Journal |
28927721 | 20180201 | Agonistic effects of diverse xenobiotics on the constitutive androstane receptor as detected in a recombinant yeast-cell assay | Toxicology in vitro : an international journal published in association with BIBRA |
11431146 | 20010701 | Interactions of synthetic estrogens with human estrogen receptors | The Journal of endocrinology |
Complexity: | 293 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 242.167065321 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 242.167065321 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 20.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 5.3 |
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