1-氯丙烷
TL;DR: 1-氯丙烷 (CAS 540-54-5) is a chemical compound with molecular formula C3H7Cl and molecular weight 78.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-氯丙烷
1-chloropropane
Also Known As: 1-CHLOROPROPANE, Propyl chloride, N-Propyl chloride, Propane, 1-chloro-, Chloropropane
| Molecular Formula | C3H7Cl |
|---|---|
| Molecular Weight | 78.02 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 78.02363 |
| Heavy Atoms | 4 |
| Complexity | 7.0 |
| Melting Point | -122.8 °C |
| Boiling Point | 115 to 47.2 °C at 760 mmHg |
| Density | 0.892 - Less dense than water; will float |
| Solubility | In water, 2720 mg/L at 25 °C |
| Flash Point | -17.8 °C |
| Vapor Pressure | 345.0 [mmHg] |
| Refractive Index | 1.3879 at 20 °C |
Chemical Identifiers
| CAS Number | 540-54-5 |
|---|---|
| SMILES | CCCCl |
| InChIKey | SNMVRZFUUCLYTO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-氯丙烷 (CAS 540-54-5), with molecular formula C3H7Cl and molecular weight 78.02 g/mol. IUPAC: 1-chloropropane.
Chemical Property Profile of 1-氯丙烷
Property Insights of 1-氯丙烷
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-氯丙烷. With a topological polar surface area (TPSA) of 0.0 Ų, 1-氯丙烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-氯丙烷 has 0 hydrogen bond donor(s) and 0 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 1-氯丙烷?
The CAS number of 1-氯丙烷 is 540-54-5.
What is the molecular formula of 1-氯丙烷?
The molecular formula of 1-氯丙烷 is C3H7Cl.
What is the molecular weight of 1-氯丙烷?
The molecular weight of 1-氯丙烷 is 78.02 g/mol.
Where can I buy 1-氯丙烷?
You can request a quote for 1-氯丙烷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-氯丙烷?
Yes, KEHONG BIO provides custom synthesis services for 1-氯丙烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.