異戊烯醇
TL;DR: 異戊烯醇 (CAS 556-82-1) is a chemical compound with molecular formula C5H10O and molecular weight 86.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
異戊烯醇
3-methylbut-2-en-1-ol
Also Known As: Prenol, 3-METHYL-2-BUTEN-1-OL, 3-Methylbut-2-en-1-ol, Prenyl alcohol, 3-Methyl-2-butenol
| Molecular Formula | C5H10O |
|---|---|
| Molecular Weight | 86.07 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 86.073166 |
| Heavy Atoms | 6 |
| Complexity | 51.0 |
| Melting Point | -59.3 °C |
| Boiling Point | 138.00 to 174.00 °C. @ 760.00 mm Hg |
| Density | 0.85 g/cm³ |
| Solubility | Solubility in water, g/100ml at 20 °C: 17 (good) |
| Flash Point | 50 °C c.c. |
| Vapor Pressure | 1.05 [mmHg] |
| Refractive Index | 1.438-1.448 |
Chemical Identifiers
| CAS Number | 556-82-1 |
|---|---|
| SMILES | CC(=CCO)C |
| InChIKey | ASUAYTHWZCLXAN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
異戊烯醇 (CAS 556-82-1), with molecular formula C5H10O and molecular weight 86.07 g/mol. IUPAC: 3-methylbut-2-en-1-ol.
Chemical Property Profile of 異戊烯醇
Property Insights of 異戊烯醇
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 異戊烯醇. With a topological polar surface area (TPSA) of 20.2 Ų, 異戊烯醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 異戊烯醇 has 1 hydrogen bond donor(s) and 1 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 異戊烯醇?
The CAS number of 異戊烯醇 is 556-82-1.
What is the molecular formula of 異戊烯醇?
The molecular formula of 異戊烯醇 is C5H10O.
What is the molecular weight of 異戊烯醇?
The molecular weight of 異戊烯醇 is 86.07 g/mol.
Where can I buy 異戊烯醇?
You can request a quote for 異戊烯醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 異戊烯醇?
Yes, KEHONG BIO provides custom synthesis services for 異戊烯醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.