3-乙酰丙醇
TL;DR: 3-乙酰丙醇 (CAS 1071-73-4) is a chemical compound with molecular formula C5H10O2 and molecular weight 102.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-乙酰丙醇
5-hydroxypentan-2-one
Also Known As: 3-Acetyl-1-propanol, 5-Hydroxypentan-2-one, 5-Hydroxy-2-pentanone, 3-Acetopropanol, 3-Acetylpropanol
| Molecular Formula | C5H10O2 |
|---|---|
| Molecular Weight | 102.07 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 102.06808 |
| Heavy Atoms | 7 |
| Complexity | 59.0 |
Chemical Identifiers
| CAS Number | 1071-73-4 |
|---|---|
| SMILES | CC(=O)CCCO |
| InChIKey | JSHPTIGHEWEXRW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-乙酰丙醇 (CAS 1071-73-4), with molecular formula C5H10O2 and molecular weight 102.07 g/mol. IUPAC: 5-hydroxypentan-2-one.
Chemical Property Profile of 3-乙酰丙醇
Property Insights of 3-乙酰丙醇
The XLogP value of -0.4 indicates that 3-乙酰丙醇 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 37.3 Ų, 3-乙酰丙醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-乙酰丙醇 has 1 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 3-乙酰丙醇?
The CAS number of 3-乙酰丙醇 is 1071-73-4.
What is the molecular formula of 3-乙酰丙醇?
The molecular formula of 3-乙酰丙醇 is C5H10O2.
What is the molecular weight of 3-乙酰丙醇?
The molecular weight of 3-乙酰丙醇 is 102.07 g/mol.
Where can I buy 3-乙酰丙醇?
You can request a quote for 3-乙酰丙醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-乙酰丙醇?
Yes, KEHONG BIO provides custom synthesis services for 3-乙酰丙醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.