2-Bromo-2,4,4-trimethyl-3-pentanone
TL;DR: 2-Bromo-2,4,4-trimethyl-3-pentanone (CAS 55007-44-8) is a chemical compound with molecular formula C8H15BrO and molecular weight 206.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-2,4,4-trimethylpentan-3-one
Also Known As: 2-bromo-2,4,4-trimethylpentan-3-one, 2-bromo-2,4,4-trimethyl-pentan-3-one, 3-Pentanone, 2-bromo-2,4,4-trimethyl-, 2-BROMO-2,4,4-TRIMETHYL-3-PENTANONE, 659-989-8
| Molecular Formula | C8H15BrO |
|---|---|
| Molecular Weight | 206.03 g/mol |
| LogP | 2.7751 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 206.03062 |
| Heavy Atoms | 10 |
| Complexity | 120.31703 |
Chemical Identifiers
| CAS Number | 55007-44-8 |
|---|---|
| SMILES | CC(C)(C)C(=O)C(C)(C)Br |
Product Overview
2-Bromo-2,4,4-trimethyl-3-pentanone (CAS 55007-44-8), with molecular formula C8H15BrO and molecular weight 206.03 g/mol. IUPAC: 2-bromo-2,4,4-trimethylpentan-3-one.
Chemical Property Profile of 2-Bromo-2,4,4-trimethyl-3-pentanone
Property Insights of 2-Bromo-2,4,4-trimethyl-3-pentanone
The XLogP value of 2.7751 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-2,4,4-trimethyl-3-pentanone. With a topological polar surface area (TPSA) of 17.07 Ų, 2-Bromo-2,4,4-trimethyl-3-pentanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-2,4,4-trimethyl-3-pentanone 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 2-Bromo-2,4,4-trimethyl-3-pentanone?
The CAS number of 2-Bromo-2,4,4-trimethyl-3-pentanone is 55007-44-8.
What is the molecular formula of 2-Bromo-2,4,4-trimethyl-3-pentanone?
The molecular formula of 2-Bromo-2,4,4-trimethyl-3-pentanone is C8H15BrO.
What is the molecular weight of 2-Bromo-2,4,4-trimethyl-3-pentanone?
The molecular weight of 2-Bromo-2,4,4-trimethyl-3-pentanone is 206.03 g/mol.
Where can I buy 2-Bromo-2,4,4-trimethyl-3-pentanone?
You can request a quote for 2-Bromo-2,4,4-trimethyl-3-pentanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-2,4,4-trimethyl-3-pentanone?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-2,4,4-trimethyl-3-pentanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.