3-氯-1,2-丙二醇
TL;DR: 3-氯-1,2-丙二醇 (CAS 96-24-2) is a chemical compound with molecular formula C3H7ClO2 and molecular weight 110.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-氯-1,2-丙二醇
3-chloropropane-1,2-diol
Also Known As: 3-Chloro-1,2-propanediol, 3-Chloropropane-1,2-diol, alpha-Chlorohydrin, Epibloc, Chlorodeoxyglycerol
| Molecular Formula | C3H7ClO2 |
|---|---|
| Molecular Weight | 110.01 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 110.01346 |
| Heavy Atoms | 6 |
| Complexity | 32.0 |
| Melting Point | -40.0 °C |
| Boiling Point | 212.8 °C at 760 mmHg (decomposes) |
| Density | 1.326 at 17.8 °C |
| Solubility | greater than or equal to 100 mg/mL at 70 °F (NTP, 1992) |
| Flash Point | 58.9 °C |
| Vapor Pressure | 3.75 mmHg at 25.0 °C |
| Refractive Index | 1.4831 @ 20 °C; BP: 213 °C WITH DECOMP |
Chemical Identifiers
| CAS Number | 96-24-2 |
|---|---|
| SMILES | C(C(CCl)O)O |
| InChIKey | SSZWWUDQMAHNAQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-氯-1,2-丙二醇 (CAS 96-24-2), with molecular formula C3H7ClO2 and molecular weight 110.01 g/mol. IUPAC: 3-chloropropane-1,2-diol.
Chemical Property Profile of 3-氯-1,2-丙二醇
Property Insights of 3-氯-1,2-丙二醇
The XLogP value of -0.5 indicates that 3-氯-1,2-丙二醇 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.5 Ų, 3-氯-1,2-丙二醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-氯-1,2-丙二醇 has 2 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-氯-1,2-丙二醇?
The CAS number of 3-氯-1,2-丙二醇 is 96-24-2.
What is the molecular formula of 3-氯-1,2-丙二醇?
The molecular formula of 3-氯-1,2-丙二醇 is C3H7ClO2.
What is the molecular weight of 3-氯-1,2-丙二醇?
The molecular weight of 3-氯-1,2-丙二醇 is 110.01 g/mol.
Where can I buy 3-氯-1,2-丙二醇?
You can request a quote for 3-氯-1,2-丙二醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-氯-1,2-丙二醇?
Yes, KEHONG BIO provides custom synthesis services for 3-氯-1,2-丙二醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.