Carvacrol - CAS 499-75-2
Catalog: |
BB026870 |
Product Name: |
Carvacrol |
CAS: |
499-75-2 |
Synonyms: |
2-methyl-5-propan-2-ylphenol |
IUPAC Name: | 2-methyl-5-propan-2-ylphenol |
Description: | 5-Isopropyl-2-methylphenol presents antidepressant effects in the forced swimming and tail suspension tests; this effect seems to be dependent on its interaction with the dopaminergic system, but not with the serotonergic and noradrenergic systems. |
Molecular Weight: | 150.22 |
Molecular Formula: | C10H14O |
Canonical SMILES: | CC1=C(C=C(C=C1)C(C)C)O |
InChI: | InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4-7,11H,1-3H3 |
InChI Key: | RECUKUPTGUEGMW-UHFFFAOYSA-N |
Boiling Point: | 238 °C |
Melting Point: | 3°C |
Flash Point: | 100 °C |
Purity: | > 98 % |
Density: | 0.97 g/cm3 |
Solubility: | Slightly sol in water; sol in ethanol, Ether, Alkalis; very soluble in acetone |
Appearance: | Oil |
MDL: | MFCD00002236 |
LogP: | 2.82400 |
Quality Standard: | Enterprise Standard |
Refractive Index: | n20/D 1.522(lit.) |
Stability: | Stable. Combustible. Incompatible with strong bases, strong oxidizing agents. |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P272, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P332+P313, P333+P313, P337+P313, P362, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
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PMID | Publication Date | Title | Journal |
32535744 | 20210401 | TRPV3 enhances skin keratinocyte proliferation through EGFR-dependent signaling pathways | Cell biology and toxicology |
31124249 | 20191001 | Glucosylation of the phytoalexin N-feruloyl tyramine modulates the levels of pathogen-responsive metabolites in Nicotiana benthamiana | The Plant journal : for cell and molecular biology |
30377214 | 20190101 | Pharmacological Inhibition of the Temperature-Sensitive and Ca2+-Permeable Transient Receptor Potential Vanilloid TRPV3 Channel by Natural Forsythoside B Attenuates Pruritus and Cytotoxicity of Keratinocytes | The Journal of pharmacology and experimental therapeutics |
30392869 | 20190101 | Carvacrol ameliorates behavioral disturbances and DNA damage in the brain of rats exposed to propiconazole | Neurotoxicology |
29019276 | 20180701 | Benzo(a)pyrene induces lung toxicity and inflammation in mice: prevention by carvacrol | Human & experimental toxicology |
Complexity: | 120 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 150.104465066 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 150.104465066 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 20.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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