2-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl-
TL;DR: 2-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl- (CAS 1889-99-2) is a chemical compound with molecular formula C9H13BrO2 and molecular weight 232.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-2-hydroxy-4,4,5,5-tetramethylcyclopent-2-en-1-one
Also Known As: 3-Bromo-2-hydroxy-4,4,5,5-tetramethylcyclopent-2-en-1-one, Bromo-2-hydroxy-4,4,5,5-tetramethylcyclopenten-3-one, 2-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl-, 3-Bromo-2-hydroxy-4,4,5,5-tetramethylcyclopent-2-enone, 3-bromo-2-hydroxy-4,4,5,5-tetramethylcyclopenta-2-enone
| Molecular Formula | C9H13BrO2 |
|---|---|
| Molecular Weight | 232.01 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 232.00989 |
| Heavy Atoms | 12 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 1889-99-2 |
|---|---|
| SMILES | CC1(C(=C(C(=O)C1(C)C)O)Br)C |
| InChIKey | ZAUGLWIVUJBQBG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl- (CAS 1889-99-2), with molecular formula C9H13BrO2 and molecular weight 232.01 g/mol. IUPAC: 3-bromo-2-hydroxy-4,4,5,5-tetramethylcyclopent-2-en-1-one.
Chemical Property Profile of 2-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl-
Property Insights of 2-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl-. With a topological polar surface area (TPSA) of 37.3 Ų, 2-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl- has 1 hydrogen bond donor(s) and 2 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-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl-?
The CAS number of 2-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl- is 1889-99-2.
What is the molecular formula of 2-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl-?
The molecular formula of 2-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl- is C9H13BrO2.
What is the molecular weight of 2-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl-?
The molecular weight of 2-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl- is 232.01 g/mol.
Where can I buy 2-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl-?
You can request a quote for 2-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.