丁酰氯
TL;DR: 丁酰氯 (CAS 141-75-3) is a chemical compound with molecular formula C4H7ClO and molecular weight 106.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丁酰氯
butanoyl chloride
Also Known As: Butyryl chloride, Butanoyl chloride, Butyrylchloride, N-BUTYRYL CHLORIDE, Butyric chloride
| Molecular Formula | C4H7ClO |
|---|---|
| Molecular Weight | 106.02 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 106.01854 |
| Heavy Atoms | 6 |
| Complexity | 51.0 |
| Melting Point | -88.9 °C |
| Boiling Point | 102.2 °C at 760 mmHg |
| Density | 1.0277 at 20.0 °C |
| Solubility | Reaction (NTP, 1992) |
| Flash Point | 21.7 °C |
| Vapor Pressure | 18.8 mmHg at -2.2 °C ; 41.7 mmHg at 25.0 °C; 95.2 mmHg at 42.2 °C |
| Refractive Index | 1.4121 at 20 °C |
Chemical Identifiers
| CAS Number | 141-75-3 |
|---|---|
| SMILES | CCCC(=O)Cl |
| InChIKey | DVECBJCOGJRVPX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
丁酰氯 (CAS 141-75-3), with molecular formula C4H7ClO and molecular weight 106.02 g/mol. IUPAC: butanoyl chloride.
Chemical Property Profile of 丁酰氯
Property Insights of 丁酰氯
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 丁酰氯. With a topological polar surface area (TPSA) of 17.1 Ų, 丁酰氯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 丁酰氯 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 丁酰氯?
The CAS number of 丁酰氯 is 141-75-3.
What is the molecular formula of 丁酰氯?
The molecular formula of 丁酰氯 is C4H7ClO.
What is the molecular weight of 丁酰氯?
The molecular weight of 丁酰氯 is 106.02 g/mol.
Where can I buy 丁酰氯?
You can request a quote for 丁酰氯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丁酰氯?
Yes, KEHONG BIO provides custom synthesis services for 丁酰氯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.