2-Bromo-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one
TL;DR: 2-Bromo-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one (CAS 5896-66-2) is a chemical compound with molecular formula C12H13BrO and molecular weight 252.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone
Also Known As: 2-bromo-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one, 2-bromo-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone, 2-bromo-1-tetralin-6-yl-ethanone, 6-bromoacetyl-1,2,3,4-tetrahydronaphthalene, 2-bromo-1-(1,2,3,4-tetrahydronaphthalen-7-yl)ethan
| Molecular Formula | C12H13BrO |
|---|---|
| Molecular Weight | 252.01 g/mol |
| LogP | 3.143 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 252.01498 |
| Heavy Atoms | 14 |
| Complexity | 357.33942 |
Chemical Identifiers
| CAS Number | 5896-66-2 |
|---|---|
| SMILES | C1CCC2=C(C1)C=CC(=C2)C(=O)CBr |
Product Overview
2-Bromo-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one (CAS 5896-66-2), with molecular formula C12H13BrO and molecular weight 252.01 g/mol. IUPAC: 2-bromo-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone.
Chemical Property Profile of 2-Bromo-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one
Property Insights of 2-Bromo-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one
The XLogP value of 3.143 indicates that 2-Bromo-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 2-Bromo-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethan-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 2-Bromo-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one?
The CAS number of 2-Bromo-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one is 5896-66-2.
What is the molecular formula of 2-Bromo-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one?
The molecular formula of 2-Bromo-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one is C12H13BrO.
What is the molecular weight of 2-Bromo-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one?
The molecular weight of 2-Bromo-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one is 252.01 g/mol.
Where can I buy 2-Bromo-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one?
You can request a quote for 2-Bromo-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.