2,6-Octadien-1-ol, 3,7-dimethyl-, 2-aminobenzoate, (2E)-
TL;DR: 2,6-Octadien-1-ol, 3,7-dimethyl-, 2-aminobenzoate, (2E)- (CAS 67859-99-8) is a chemical compound with molecular formula C17H23NO2 and molecular weight 273.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7-dimethylocta-2,6-dienyl 2-aminobenzoate
Also Known As: Neryl anthranilate, Geranyl anthranilate, 3,7-dimethylocta-2,6-dienyl 2-aminobenzoate, 2,6-Octadien-1-ol, 3,7-dimethyl-, 2-aminobenzoate, (2E)-, 2-aminobenzoic acid,3,7-dimethylocta-2,6-dien-1-ol
| Molecular Formula | C17H23NO2 |
|---|---|
| Molecular Weight | 273.17 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 273.17288 |
| Heavy Atoms | 20 |
| Complexity | 367.0 |
Chemical Identifiers
| CAS Number | 67859-99-8 |
|---|---|
| SMILES | CC(=CCCC(=CCOC(=O)C1=CC=CC=C1N)C)C |
| InChIKey | QLRICECRKJGSKQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,6-Octadien-1-ol, 3,7-dimethyl-, 2-aminobenzoate, (2E)- (CAS 67859-99-8), with molecular formula C17H23NO2 and molecular weight 273.17 g/mol. IUPAC: 3,7-dimethylocta-2,6-dienyl 2-aminobenzoate.
Chemical Property Profile of 2,6-Octadien-1-ol, 3,7-dimethyl-, 2-aminobenzoate, (2E)-
Property Insights of 2,6-Octadien-1-ol, 3,7-dimethyl-, 2-aminobenzoate, (2E)-
The XLogP value of 5.0 indicates that 2,6-Octadien-1-ol, 3,7-dimethyl-, 2-aminobenzoate, (2E)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.3 Ų, 2,6-Octadien-1-ol, 3,7-dimethyl-, 2-aminobenzoate, (2E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Octadien-1-ol, 3,7-dimethyl-, 2-aminobenzoate, (2E)- has 1 hydrogen bond donor(s) and 3 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 2,6-Octadien-1-ol, 3,7-dimethyl-, 2-aminobenzoate, (2E)-?
The CAS number of 2,6-Octadien-1-ol, 3,7-dimethyl-, 2-aminobenzoate, (2E)- is 67859-99-8.
What is the molecular formula of 2,6-Octadien-1-ol, 3,7-dimethyl-, 2-aminobenzoate, (2E)-?
The molecular formula of 2,6-Octadien-1-ol, 3,7-dimethyl-, 2-aminobenzoate, (2E)- is C17H23NO2.
What is the molecular weight of 2,6-Octadien-1-ol, 3,7-dimethyl-, 2-aminobenzoate, (2E)-?
The molecular weight of 2,6-Octadien-1-ol, 3,7-dimethyl-, 2-aminobenzoate, (2E)- is 273.17 g/mol.
Where can I buy 2,6-Octadien-1-ol, 3,7-dimethyl-, 2-aminobenzoate, (2E)-?
You can request a quote for 2,6-Octadien-1-ol, 3,7-dimethyl-, 2-aminobenzoate, (2E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Octadien-1-ol, 3,7-dimethyl-, 2-aminobenzoate, (2E)-?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Octadien-1-ol, 3,7-dimethyl-, 2-aminobenzoate, (2E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.