三溴乙醛
TL;DR: 三溴乙醛 (CAS 115-17-3) is a chemical compound with molecular formula C2HBr3O and molecular weight 277.76 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
三溴乙醛
2,2,2-tribromoacetaldehyde
Also Known As: TRIBROMOACETALDEHYDE, Bromal, 2,2,2-Tribromoacetaldehyde, Acetaldehyde, tribromo-, tribromo
| Molecular Formula | C2HBr3O |
|---|---|
| Molecular Weight | 277.76 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 279.7557 |
| Heavy Atoms | 6 |
| Complexity | 54.0 |
| Melting Point | CRYSTALS; ODOR OF CHLORAL; PUNGENT TASTE; MP: 53.5 °C; DIPOLE MOMENT IN BENZENE: 2.56 D; DELIQUESCENT /HYDRATE/ |
| Boiling Point | ABOUT 174 °C WITH DECOMP |
| Density | 2.66 |
| Solubility | SOL IN WATER, ALCOHOL, ETHER |
| Vapor Pressure | 1.52 [mmHg] |
| Refractive Index | 1.5939 @ 20 °C |
Chemical Identifiers
| CAS Number | 115-17-3 |
|---|---|
| SMILES | C(=O)C(Br)(Br)Br |
| InChIKey | YTGSYRVSBPFKMQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
三溴乙醛 (CAS 115-17-3), with molecular formula C2HBr3O and molecular weight 277.76 g/mol. IUPAC: 2,2,2-tribromoacetaldehyde.
Chemical Property Profile of 三溴乙醛
Property Insights of 三溴乙醛
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 三溴乙醛. With a topological polar surface area (TPSA) of 17.1 Ų, 三溴乙醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 三溴乙醛 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 三溴乙醛?
The CAS number of 三溴乙醛 is 115-17-3.
What is the molecular formula of 三溴乙醛?
The molecular formula of 三溴乙醛 is C2HBr3O.
What is the molecular weight of 三溴乙醛?
The molecular weight of 三溴乙醛 is 277.76 g/mol.
Where can I buy 三溴乙醛?
You can request a quote for 三溴乙醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 三溴乙醛?
Yes, KEHONG BIO provides custom synthesis services for 三溴乙醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.