正戊醛
TL;DR: 正戊醛 (CAS 110-62-3) 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.
正戊醛
pentanal
Also Known As: Valeraldehyde, PENTANAL, n-Valeraldehyde, n-Pentanal, Valeric aldehyde
| Molecular Formula | C5H10O |
|---|---|
| Molecular Weight | 86.07 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 86.073166 |
| Heavy Atoms | 6 |
| Complexity | 32.0 |
| Melting Point | -91.5 °C |
| Boiling Point | 216 to 102.8 °C at 760 mmHg |
| Density | 0.811 at 20.0 °C - Less dense than water; will float |
| Solubility | less than 1 mg/mL at 68 °F (NTP, 1992) |
| Flash Point | 12.0 °C |
| Vapor Pressure | 50 mmHg at 25.0 °C |
| Refractive Index | = 1.3944 at 20 °C |
Chemical Identifiers
| CAS Number | 110-62-3 |
|---|---|
| SMILES | CCCCC=O |
| InChIKey | HGBOYTHUEUWSSQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
正戊醛 (CAS 110-62-3), with molecular formula C5H10O and molecular weight 86.07 g/mol. IUPAC: pentanal.
Chemical Property Profile of 正戊醛
Property Insights of 正戊醛
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 正戊醛. With a topological polar surface area (TPSA) of 17.1 Ų, 正戊醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 正戊醛 has 0 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 正戊醛?
The CAS number of 正戊醛 is 110-62-3.
What is the molecular formula of 正戊醛?
The molecular formula of 正戊醛 is C5H10O.
What is the molecular weight of 正戊醛?
The molecular weight of 正戊醛 is 86.07 g/mol.
Where can I buy 正戊醛?
You can request a quote for 正戊醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 正戊醛?
Yes, KEHONG BIO provides custom synthesis services for 正戊醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.