Cyclopentanol, 1,2-dimethyl-3-(1-methylethenyl)-, 1-propanoate
TL;DR: Cyclopentanol, 1,2-dimethyl-3-(1-methylethenyl)-, 1-propanoate (CAS 98800-90-9) is a chemical compound with molecular formula C13H22O2 and molecular weight 210.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1,2-dimethyl-3-prop-1-en-2-ylcyclopentyl) propanoate
Also Known As: Cyclopentanol, 1,2-dimethyl-3-(1-methylethenyl)-, propanoate, J1.546.740A, Cyclopentanol, 1,2-dimethyl-3-(1-methylethenyl)-, 1-propanoate, (1,2-dimethyl-3-prop-1-en-2-ylcyclopentyl) propanoate, 1,2-DIMETHYL-3-(PROP-1-EN-2-YL)CYCLOPENTYL PROPANOATE
| Molecular Formula | C13H22O2 |
|---|---|
| Molecular Weight | 210.16 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 210.16199 |
| Heavy Atoms | 15 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 98800-90-9 |
|---|---|
| SMILES | CCC(=O)OC1(CCC(C1C)C(=C)C)C |
| InChIKey | HIYJITNRZNSQGH-UHFFFAOYSA-N |
Product Overview
Cyclopentanol, 1,2-dimethyl-3-(1-methylethenyl)-, 1-propanoate (CAS 98800-90-9), with molecular formula C13H22O2 and molecular weight 210.16 g/mol. IUPAC: (1,2-dimethyl-3-prop-1-en-2-ylcyclopentyl) propanoate.
Chemical Property Profile of Cyclopentanol, 1,2-dimethyl-3-(1-methylethenyl)-, 1-propanoate
Property Insights of Cyclopentanol, 1,2-dimethyl-3-(1-methylethenyl)-, 1-propanoate
The XLogP value of 3.6 indicates that Cyclopentanol, 1,2-dimethyl-3-(1-methylethenyl)-, 1-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, Cyclopentanol, 1,2-dimethyl-3-(1-methylethenyl)-, 1-propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclopentanol, 1,2-dimethyl-3-(1-methylethenyl)-, 1-propanoate 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 Cyclopentanol, 1,2-dimethyl-3-(1-methylethenyl)-, 1-propanoate?
The CAS number of Cyclopentanol, 1,2-dimethyl-3-(1-methylethenyl)-, 1-propanoate is 98800-90-9.
What is the molecular formula of Cyclopentanol, 1,2-dimethyl-3-(1-methylethenyl)-, 1-propanoate?
The molecular formula of Cyclopentanol, 1,2-dimethyl-3-(1-methylethenyl)-, 1-propanoate is C13H22O2.
What is the molecular weight of Cyclopentanol, 1,2-dimethyl-3-(1-methylethenyl)-, 1-propanoate?
The molecular weight of Cyclopentanol, 1,2-dimethyl-3-(1-methylethenyl)-, 1-propanoate is 210.16 g/mol.
Where can I buy Cyclopentanol, 1,2-dimethyl-3-(1-methylethenyl)-, 1-propanoate?
You can request a quote for Cyclopentanol, 1,2-dimethyl-3-(1-methylethenyl)-, 1-propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopentanol, 1,2-dimethyl-3-(1-methylethenyl)-, 1-propanoate?
Yes, KEHONG BIO provides custom synthesis services for Cyclopentanol, 1,2-dimethyl-3-(1-methylethenyl)-, 1-propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.