1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-propanoate
TL;DR: 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-propanoate (CAS 7149-34-0) is a chemical compound with molecular formula C18H30O2 and molecular weight 278.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7,11-trimethyldodeca-1,6,10-trien-3-yl propanoate
Also Known As: Nerolidyl propionate, 3,7,11-trimethyldodeca-1,6,10-trien-3-yl propanoate, 3,7,11-Trimethyldodeca-1,6,10-trien-3-yl propionate, 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, propanoate, 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-propanoate
| Molecular Formula | C18H30O2 |
|---|---|
| Molecular Weight | 278.22 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 278.22458 |
| Heavy Atoms | 20 |
| Complexity | 373.0 |
Chemical Identifiers
| CAS Number | 7149-34-0 |
|---|---|
| SMILES | CCC(=O)OC(C)(CCC=C(C)CCC=C(C)C)C=C |
| InChIKey | NPSBIIPKEQTFPA-UHFFFAOYSA-N |
Product Overview
1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-propanoate (CAS 7149-34-0), with molecular formula C18H30O2 and molecular weight 278.22 g/mol. IUPAC: 3,7,11-trimethyldodeca-1,6,10-trien-3-yl propanoate.
Chemical Property Profile of 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-propanoate
Property Insights of 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-propanoate
The XLogP value of 5.6 indicates that 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-propanoate has 0 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 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-propanoate?
The CAS number of 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-propanoate is 7149-34-0.
What is the molecular formula of 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-propanoate?
The molecular formula of 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-propanoate is C18H30O2.
What is the molecular weight of 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-propanoate?
The molecular weight of 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-propanoate is 278.22 g/mol.
Where can I buy 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-propanoate?
You can request a quote for 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-propanoate?
Yes, KEHONG BIO provides custom synthesis services for 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.