![[(3R)-3,7-dimethyloct-7-enyl] (2S)-2,3-dimethylbutanoate structure](/static/products/7449/74499-48-2.webp)
[(3R)-3,7-dimethyloct-7-enyl] (2S)-2,3-dimethylbutanoate
TL;DR: [(3R)-3,7-dimethyloct-7-enyl] (2S)-2,3-dimethylbutanoate (CAS 74499-48-2) is a chemical compound with molecular formula C16H30O2 and molecular weight 254.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3R)-3,7-dimethyloct-7-enyl] (2S)-2,3-dimethylbutanoate
Also Known As: alpha-Citronellyl 3-methyl-2-butenoate, 2-Butenoic acid, 3-methyl-, 3,7-dimethyl-7-octenyl ester, [(3R)-3,7-dimethyloct-7-enyl] (2S)-2,3-dimethylbutanoate, 2-Butenoic acid, 3-methyl-, 3,7-dimethyl-7-octen-1-yl ester
| Molecular Formula | C16H30O2 |
|---|---|
| Molecular Weight | 254.22 g/mol |
| LogP | 4.5943 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 254.22458 |
| Heavy Atoms | 18 |
| Complexity | 255.82257 |
Chemical Identifiers
| CAS Number | 74499-48-2 |
|---|---|
| SMILES | C[C@H](CCCC(=C)C)CCOC(=O)[C@@H](C)C(C)C |
Product Overview
[(3R)-3,7-dimethyloct-7-enyl] (2S)-2,3-dimethylbutanoate (CAS 74499-48-2), with molecular formula C16H30O2 and molecular weight 254.22 g/mol. IUPAC: [(3R)-3,7-dimethyloct-7-enyl] (2S)-2,3-dimethylbutanoate.
Chemical Property Profile of [(3R)-3,7-dimethyloct-7-enyl] (2S)-2,3-dimethylbutanoate
Property Insights of [(3R)-3,7-dimethyloct-7-enyl] (2S)-2,3-dimethylbutanoate
The XLogP value of 4.5943 indicates that [(3R)-3,7-dimethyloct-7-enyl] (2S)-2,3-dimethylbutanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, [(3R)-3,7-dimethyloct-7-enyl] (2S)-2,3-dimethylbutanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(3R)-3,7-dimethyloct-7-enyl] (2S)-2,3-dimethylbutanoate has 0 hydrogen bond donor(s) and 2 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 [(3R)-3,7-dimethyloct-7-enyl] (2S)-2,3-dimethylbutanoate?
The CAS number of [(3R)-3,7-dimethyloct-7-enyl] (2S)-2,3-dimethylbutanoate is 74499-48-2.
What is the molecular formula of [(3R)-3,7-dimethyloct-7-enyl] (2S)-2,3-dimethylbutanoate?
The molecular formula of [(3R)-3,7-dimethyloct-7-enyl] (2S)-2,3-dimethylbutanoate is C16H30O2.
What is the molecular weight of [(3R)-3,7-dimethyloct-7-enyl] (2S)-2,3-dimethylbutanoate?
The molecular weight of [(3R)-3,7-dimethyloct-7-enyl] (2S)-2,3-dimethylbutanoate is 254.22 g/mol.
Where can I buy [(3R)-3,7-dimethyloct-7-enyl] (2S)-2,3-dimethylbutanoate?
You can request a quote for [(3R)-3,7-dimethyloct-7-enyl] (2S)-2,3-dimethylbutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(3R)-3,7-dimethyloct-7-enyl] (2S)-2,3-dimethylbutanoate?
Yes, KEHONG BIO provides custom synthesis services for [(3R)-3,7-dimethyloct-7-enyl] (2S)-2,3-dimethylbutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.