2-Propenoic acid, 3-phenyl-, 3,7-dimethyl-6-octen-1-yl ester
TL;DR: 2-Propenoic acid, 3-phenyl-, 3,7-dimethyl-6-octen-1-yl ester (CAS 10482-79-8) is a chemical compound with molecular formula C19H26O2 and molecular weight 286.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7-dimethyloct-6-enyl 3-phenylprop-2-enoate
Also Known As: Citronellyl cinnamate, 3,7-Dimethyloct-6-en-1-yl cinnamate, 3,7-Dimethyloct-6-en-1-ylcinnamate, 3,7-dimethyloct-6-enyl 3-phenylprop-2-enoate, 3,7-dimethyloct-6-enyl (E)-3-phenylprop-2-enoate
| Molecular Formula | C19H26O2 |
|---|---|
| Molecular Weight | 286.19 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 286.19327 |
| Heavy Atoms | 21 |
| Complexity | 345.0 |
Chemical Identifiers
| CAS Number | 10482-79-8 |
|---|---|
| SMILES | CC(CCC=C(C)C)CCOC(=O)C=CC1=CC=CC=C1 |
| InChIKey | KMXKQELDKDGFRN-UHFFFAOYSA-N |
Product Overview
2-Propenoic acid, 3-phenyl-, 3,7-dimethyl-6-octen-1-yl ester (CAS 10482-79-8), with molecular formula C19H26O2 and molecular weight 286.19 g/mol. IUPAC: 3,7-dimethyloct-6-enyl 3-phenylprop-2-enoate.
Chemical Property Profile of 2-Propenoic acid, 3-phenyl-, 3,7-dimethyl-6-octen-1-yl ester
Property Insights of 2-Propenoic acid, 3-phenyl-, 3,7-dimethyl-6-octen-1-yl ester
The XLogP value of 6.3 indicates that 2-Propenoic acid, 3-phenyl-, 3,7-dimethyl-6-octen-1-yl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Propenoic acid, 3-phenyl-, 3,7-dimethyl-6-octen-1-yl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propenoic acid, 3-phenyl-, 3,7-dimethyl-6-octen-1-yl ester 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 2-Propenoic acid, 3-phenyl-, 3,7-dimethyl-6-octen-1-yl ester?
The CAS number of 2-Propenoic acid, 3-phenyl-, 3,7-dimethyl-6-octen-1-yl ester is 10482-79-8.
What is the molecular formula of 2-Propenoic acid, 3-phenyl-, 3,7-dimethyl-6-octen-1-yl ester?
The molecular formula of 2-Propenoic acid, 3-phenyl-, 3,7-dimethyl-6-octen-1-yl ester is C19H26O2.
What is the molecular weight of 2-Propenoic acid, 3-phenyl-, 3,7-dimethyl-6-octen-1-yl ester?
The molecular weight of 2-Propenoic acid, 3-phenyl-, 3,7-dimethyl-6-octen-1-yl ester is 286.19 g/mol.
Where can I buy 2-Propenoic acid, 3-phenyl-, 3,7-dimethyl-6-octen-1-yl ester?
You can request a quote for 2-Propenoic acid, 3-phenyl-, 3,7-dimethyl-6-octen-1-yl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propenoic acid, 3-phenyl-, 3,7-dimethyl-6-octen-1-yl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenoic acid, 3-phenyl-, 3,7-dimethyl-6-octen-1-yl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.