EINECS 214-518-1
TL;DR: EINECS 214-518-1 (CAS 1139-17-9) is a chemical compound with molecular formula C15H26O and molecular weight 222.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,7S)-3,3,7-trimethyl-8-tricyclo[5.4.0.02,9]undecanyl]methanol
Also Known As: EINECS 214-518-1, (4,8,8-trimethyldecahydro-1,4-methanoazulen-9-yl)methanol, (1S-(1alpha,3Abeta,4alpha,8abeta,9R*))-decahydro-4,8,8-trimethyl-1,4-methanoazulene-9-methanol, [(2R,7S)-3,3,7-trimethyl-8-tricyclo[5.4.0.02,9]undecanyl]methanol, [(4S,8aR)-4,8,8-Trimethyldecahydro-1,4-methanoazulen-9-yl]methanol
| Molecular Formula | C15H26O |
|---|---|
| Molecular Weight | 222.20 g/mol |
| LogP | 3.4673 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.19836 |
| Heavy Atoms | 16 |
| Complexity | 295.8101 |
Chemical Identifiers
| CAS Number | 1139-17-9 |
|---|---|
| SMILES | C[C@]12CCCC([C@H]3C1CCC3C2CO)(C)C |
Product Overview
EINECS 214-518-1 (CAS 1139-17-9), with molecular formula C15H26O and molecular weight 222.20 g/mol. IUPAC: [(2R,7S)-3,3,7-trimethyl-8-tricyclo[5.4.0.02,9]undecanyl]methanol.
Chemical Property Profile of EINECS 214-518-1
Property Insights of EINECS 214-518-1
The XLogP value of 3.4673 indicates that EINECS 214-518-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.23 Ų, EINECS 214-518-1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, EINECS 214-518-1 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 EINECS 214-518-1?
The CAS number of EINECS 214-518-1 is 1139-17-9.
What is the molecular formula of EINECS 214-518-1?
The molecular formula of EINECS 214-518-1 is C15H26O.
What is the molecular weight of EINECS 214-518-1?
The molecular weight of EINECS 214-518-1 is 222.20 g/mol.
Where can I buy EINECS 214-518-1?
You can request a quote for EINECS 214-518-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 214-518-1?
Yes, KEHONG BIO provides custom synthesis services for EINECS 214-518-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.