RefChem:499444
TL;DR: RefChem:499444 (CAS 126646-07-9) is a chemical compound with molecular formula C15H22O and molecular weight 218.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-methyl-4-(8-tricyclo[5.2.1.02,6]dec-4-enyl)but-3-en-2-ol
Also Known As: 3-Buten-2-ol, 4-(3a,4,5,6,7,7a-hexahydro-4,7-methano-1H-inden-5(or 6)-yl)-3-methyl-, 3-Buten-2-ol, 4-(3a,4,5,6,7,7a-hexahydro-4,7-methano-1H-inden-5-yl)-3-methyl-, 3-Buten-2-ol, 4-[3a,4,5,6,7,7a-hexahydro-4,7-methano-1H-inden-5(or 6)-yl]-3-methyl-, 3-Buten-2-ol, 4-[3a,4,5,6,7,7a-hexahydro- 4,7-methano-1H-inden-5(or 6)-yl]-3-methyl-, RefChem:499444
| Molecular Formula | C15H22O |
|---|---|
| Molecular Weight | 218.17 g/mol |
| LogP | 3.1618 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.16707 |
| Heavy Atoms | 16 |
| Complexity | 339.34412 |
Chemical Identifiers
| CAS Number | 126646-07-9 |
|---|---|
| SMILES | CC(/C(=C/C1CC2CC1C3C2CC=C3)/C)O |
Product Overview
RefChem:499444 (CAS 126646-07-9), with molecular formula C15H22O and molecular weight 218.17 g/mol. IUPAC: (E)-3-methyl-4-(8-tricyclo[5.2.1.02,6]dec-4-enyl)but-3-en-2-ol.
Chemical Property Profile of RefChem:499444
Property Insights of RefChem:499444
The XLogP value of 3.1618 indicates that RefChem:499444 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.23 Ų, RefChem:499444 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:499444 has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:499444?
The CAS number of RefChem:499444 is 126646-07-9.
What is the molecular formula of RefChem:499444?
The molecular formula of RefChem:499444 is C15H22O.
What is the molecular weight of RefChem:499444?
The molecular weight of RefChem:499444 is 218.17 g/mol.
Where can I buy RefChem:499444?
You can request a quote for RefChem:499444 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:499444?
Yes, KEHONG BIO provides custom synthesis services for RefChem:499444 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.