1,3-二溴丙烷
TL;DR: 1,3-二溴丙烷 (CAS 109-64-8) is a chemical compound with molecular formula C3H6Br2 and molecular weight 199.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-二溴丙烷
1,3-dibromopropane
Also Known As: 1,3-DIBROMOPROPANE, Trimethylene bromide, Trimethylene dibromide, Propane, 1,3-dibromo-, 1,3-dibrompropan
| Molecular Formula | C3H6Br2 |
|---|---|
| Molecular Weight | 199.88 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 | 201.88158 |
| Heavy Atoms | 5 |
| Complexity | 12.0 |
| Melting Point | -36 °C |
| Boiling Point | 167 °C |
| Density | 1.9712 g/cu cm at 15 °C |
| Solubility | 1.68 g/L in water at 30 °C. Soluble in alcohol and ether |
| Flash Point | Flash point: -34.4 °C |
| Vapor Pressure | 1.36 [mmHg] |
| Refractive Index | = 1.5249 at 15 °C |
Chemical Identifiers
| CAS Number | 109-64-8 |
|---|---|
| SMILES | C(CBr)CBr |
| InChIKey | VEFLKXRACNJHOV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-二溴丙烷 (CAS 109-64-8), with molecular formula C3H6Br2 and molecular weight 199.88 g/mol. IUPAC: 1,3-dibromopropane.
Chemical Property Profile of 1,3-二溴丙烷
Property Insights of 1,3-二溴丙烷
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-二溴丙烷. With a topological polar surface area (TPSA) of 0.0 Ų, 1,3-二溴丙烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-二溴丙烷 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 1,3-二溴丙烷?
The CAS number of 1,3-二溴丙烷 is 109-64-8.
What is the molecular formula of 1,3-二溴丙烷?
The molecular formula of 1,3-二溴丙烷 is C3H6Br2.
What is the molecular weight of 1,3-二溴丙烷?
The molecular weight of 1,3-二溴丙烷 is 199.88 g/mol.
Where can I buy 1,3-二溴丙烷?
You can request a quote for 1,3-二溴丙烷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-二溴丙烷?
Yes, KEHONG BIO provides custom synthesis services for 1,3-二溴丙烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.