4-Bromo-2-methylcyclopent-2-en-1-one
TL;DR: 4-Bromo-2-methylcyclopent-2-en-1-one (CAS 147297-98-1) is a chemical compound with molecular formula C6H7BrO and molecular weight 173.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-2-methylcyclopent-2-en-1-one
Also Known As: 2-methyl-4-bromocyclopent-2-en-1-one, 2-Methyl-4-bromo-2-cyclopenten-1-one, 4-bromo-2-methylcyclopent-2-en-1-one, 4-bromo-2-methyl-cyclopent-2-en-1-one
| Molecular Formula | C6H7BrO |
|---|---|
| Molecular Weight | 173.97 g/mol |
| LogP | 1.669 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 173.96803 |
| Heavy Atoms | 8 |
| Complexity | 148.60753 |
Chemical Identifiers
| CAS Number | 147297-98-1 |
|---|---|
| SMILES | CC1=CC(CC1=O)Br |
Product Overview
4-Bromo-2-methylcyclopent-2-en-1-one (CAS 147297-98-1), with molecular formula C6H7BrO and molecular weight 173.97 g/mol. IUPAC: 4-bromo-2-methylcyclopent-2-en-1-one.
Chemical Property Profile of 4-Bromo-2-methylcyclopent-2-en-1-one
Property Insights of 4-Bromo-2-methylcyclopent-2-en-1-one
The XLogP value of 1.669 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-2-methylcyclopent-2-en-1-one. With a topological polar surface area (TPSA) of 17.07 Ų, 4-Bromo-2-methylcyclopent-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-2-methylcyclopent-2-en-1-one 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 4-Bromo-2-methylcyclopent-2-en-1-one?
The CAS number of 4-Bromo-2-methylcyclopent-2-en-1-one is 147297-98-1.
What is the molecular formula of 4-Bromo-2-methylcyclopent-2-en-1-one?
The molecular formula of 4-Bromo-2-methylcyclopent-2-en-1-one is C6H7BrO.
What is the molecular weight of 4-Bromo-2-methylcyclopent-2-en-1-one?
The molecular weight of 4-Bromo-2-methylcyclopent-2-en-1-one is 173.97 g/mol.
Where can I buy 4-Bromo-2-methylcyclopent-2-en-1-one?
You can request a quote for 4-Bromo-2-methylcyclopent-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-2-methylcyclopent-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-2-methylcyclopent-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.