![2-[(1S,4R)-4-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol structure](/static/products/3556/3556-78-3.webp)
2-[(1S,4R)-4-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol
TL;DR: 2-[(1S,4R)-4-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol (CAS 3556-78-3) is a chemical compound with molecular formula C21H30O2 and molecular weight 314.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(1S,4R)-4-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol
Also Known As: Cyclohexanebutanoic acid, manganese(2+) salt, Resorcinol, 2-p-mentha-1,8-dien-3-yl-5-pentyl-, (+-)-, 2-[(1S,4R)-4-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol, 1,3-Benzenediol, 2-(4-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl)-5-pentyl-, trans-, 1,3-Benzenediol, 2-[4-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]-5-pentyl-, trans-
| Molecular Formula | C21H30O2 |
|---|---|
| Molecular Weight | 314.22 g/mol |
| LogP | 6.9 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 314.22458 |
| Heavy Atoms | 23 |
| Complexity | 402.0 |
Chemical Identifiers
| CAS Number | 3556-78-3 |
|---|---|
| SMILES | CCCCCC1=CC(=C(C(=C1)O)[C@H]2C=C[C@@H](CC2C(=C)C)C)O |
| InChIKey | VJTGVYHAJXYDLE-LUIZSJORSA-N |
Product Overview
2-[(1S,4R)-4-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol (CAS 3556-78-3), with molecular formula C21H30O2 and molecular weight 314.22 g/mol. IUPAC: 2-[(1S,4R)-4-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol.
Chemical Property Profile of 2-[(1S,4R)-4-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol
Property Insights of 2-[(1S,4R)-4-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol
The XLogP value of 6.9 indicates that 2-[(1S,4R)-4-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 2-[(1S,4R)-4-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(1S,4R)-4-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[(1S,4R)-4-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol?
The CAS number of 2-[(1S,4R)-4-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol is 3556-78-3.
What is the molecular formula of 2-[(1S,4R)-4-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol?
The molecular formula of 2-[(1S,4R)-4-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol is C21H30O2.
What is the molecular weight of 2-[(1S,4R)-4-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol?
The molecular weight of 2-[(1S,4R)-4-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol is 314.22 g/mol.
Where can I buy 2-[(1S,4R)-4-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol?
You can request a quote for 2-[(1S,4R)-4-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(1S,4R)-4-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol?
Yes, KEHONG BIO provides custom synthesis services for 2-[(1S,4R)-4-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.