1,2-二溴-3-氯丙烷
TL;DR: 1,2-二溴-3-氯丙烷 (CAS 96-12-8) is a chemical compound with molecular formula C3H5Br2Cl and molecular weight 233.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-二溴-3-氯丙烷
1,2-dibromo-3-chloropropane
Also Known As: 1,2-DIBROMO-3-CHLOROPROPANE, Fumazone, Nemagon, Nemafume, Nemapaz
| Molecular Formula | C3H5Br2Cl |
|---|---|
| Molecular Weight | 233.84 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.8426 |
| Heavy Atoms | 6 |
| Complexity | 32.0 |
| Melting Point | 6.1 °C |
| Boiling Point | 196.1 °C at 760 mmHg |
| Density | 2.08 at 20.0 °C |
| Solubility | less than 0.1 mg/mL at 64 °F (NTP, 1992) |
| Flash Point | 76.7 °C |
| Vapor Pressure | 0.8 mmHg at 21.1 °C |
| Refractive Index | 1.553 AT 14 °C |
Chemical Identifiers
| CAS Number | 96-12-8 |
|---|---|
| SMILES | C(C(CBr)Br)Cl |
| InChIKey | WBEJYOJJBDISQU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-二溴-3-氯丙烷 (CAS 96-12-8), with molecular formula C3H5Br2Cl and molecular weight 233.84 g/mol. IUPAC: 1,2-dibromo-3-chloropropane.
Chemical Property Profile of 1,2-二溴-3-氯丙烷
Property Insights of 1,2-二溴-3-氯丙烷
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-二溴-3-氯丙烷. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2-二溴-3-氯丙烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-二溴-3-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 1,2-二溴-3-氯丙烷?
The CAS number of 1,2-二溴-3-氯丙烷 is 96-12-8.
What is the molecular formula of 1,2-二溴-3-氯丙烷?
The molecular formula of 1,2-二溴-3-氯丙烷 is C3H5Br2Cl.
What is the molecular weight of 1,2-二溴-3-氯丙烷?
The molecular weight of 1,2-二溴-3-氯丙烷 is 233.84 g/mol.
Where can I buy 1,2-二溴-3-氯丙烷?
You can request a quote for 1,2-二溴-3-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 1,2-二溴-3-氯丙烷?
Yes, KEHONG BIO provides custom synthesis services for 1,2-二溴-3-氯丙烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.