(4R)-1-Methyl-4-(1-propen-2-yl)-2-cyclohexenol - CAS 861892-40-2
Catalog: |
BB037847 |
Product Name: |
(4R)-1-Methyl-4-(1-propen-2-yl)-2-cyclohexenol |
CAS: |
861892-40-2 |
Synonyms: |
(4R)-1-methyl-4-(1-methylethenyl)-1-cyclohex-2-enol; (4R)-1-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol |
IUPAC Name: | (4R)-1-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol |
Description: | (4R)-1-Methyl-4-(1-propen-2-yl)-2-cyclohexenol (CAS# 861892-40-2) is a chemical reagent used in the synthesis of Δ8-THC cannabinoid analogs with activity against CB receptors. |
Molecular Weight: | 152.23 |
Molecular Formula: | C10H16O |
Canonical SMILES: | CC(=C)C1CCC(C=C1)(C)O |
InChI: | InChI=1S/C10H16O/c1-8(2)9-4-6-10(3,11)7-5-9/h4,6,9,11H,1,5,7H2,2-3H3/t9-,10?/m0/s1 |
InChI Key: | MKPMHJQMNACGDI-RGURZIINSA-N |
LogP: | 2.27970 |
Publication Number | Title | Priority Date |
WO-2021113669-A1 | Cannabinoids and uses thereof | 20191204 |
WO-2020233502-A1 | Method for preparing cannabidiol compound | 20190517 |
WO-2020031179-A1 | Methods for synthesis of cannabinoid compounds | 20180806 |
CA-3072958-A1 | Synthesis of phytocannabinoids including a demethylation step | 20170816 |
CA-3072961-A1 | Synthesis of phytocannabinoids including a decarboxylation step | 20170816 |
Complexity: | 193 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 152.12011513 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 152.12011513 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 20.2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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