3-(Heptadecatrienyl)-1,2-benzenediol
TL;DR: 3-(Heptadecatrienyl)-1,2-benzenediol (CAS 76607-96-0) is a chemical compound with molecular formula C23H34O2 and molecular weight 342.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(1E,3E,5E)-heptadeca-1,3,5-trienyl]benzene-1,2-diol
Also Known As: 3-(Heptadecatrienyl)-1,2-benzenediol, 1,2-Benzenediol, 3-(heptadecatrienyl)-, 3-[(1E,3E,5E)-heptadeca-1,3,5-trienyl]benzene-1,2-diol
| Molecular Formula | C23H34O2 |
|---|---|
| Molecular Weight | 342.26 g/mol |
| LogP | 7.1443 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 13 |
| Exact Mass | 342.2559 |
| Heavy Atoms | 25 |
| Complexity | 541.0238 |
Chemical Identifiers
| CAS Number | 76607-96-0 |
|---|---|
| SMILES | CCCCCCCCCCC/C=C/C=C/C=C/C1=C(C(=CC=C1)O)O |
Product Overview
3-(Heptadecatrienyl)-1,2-benzenediol (CAS 76607-96-0), with molecular formula C23H34O2 and molecular weight 342.26 g/mol. IUPAC: 3-[(1E,3E,5E)-heptadeca-1,3,5-trienyl]benzene-1,2-diol.
Chemical Property Profile of 3-(Heptadecatrienyl)-1,2-benzenediol
Property Insights of 3-(Heptadecatrienyl)-1,2-benzenediol
The XLogP value of 7.1443 indicates that 3-(Heptadecatrienyl)-1,2-benzenediol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.46 Ų, 3-(Heptadecatrienyl)-1,2-benzenediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Heptadecatrienyl)-1,2-benzenediol 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 3-(Heptadecatrienyl)-1,2-benzenediol?
The CAS number of 3-(Heptadecatrienyl)-1,2-benzenediol is 76607-96-0.
What is the molecular formula of 3-(Heptadecatrienyl)-1,2-benzenediol?
The molecular formula of 3-(Heptadecatrienyl)-1,2-benzenediol is C23H34O2.
What is the molecular weight of 3-(Heptadecatrienyl)-1,2-benzenediol?
The molecular weight of 3-(Heptadecatrienyl)-1,2-benzenediol is 342.26 g/mol.
Where can I buy 3-(Heptadecatrienyl)-1,2-benzenediol?
You can request a quote for 3-(Heptadecatrienyl)-1,2-benzenediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Heptadecatrienyl)-1,2-benzenediol?
Yes, KEHONG BIO provides custom synthesis services for 3-(Heptadecatrienyl)-1,2-benzenediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.