2,2-Dibromo-3,4-dihydronaphthalen-1(2H)-one
TL;DR: 2,2-Dibromo-3,4-dihydronaphthalen-1(2H)-one (CAS 51114-70-6) is a chemical compound with molecular formula C10H8Br2O and molecular weight 301.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dibromo-3,4-dihydronaphthalen-1-one
Also Known As: 2,2-dibromotetralin-1-one, 2,2-Dibromo-3,4-dihydronaphthalen-1(2H)-one, 2,2-dibromo-3,4-dihydronaphthalen-1-one, 1(2H)-Naphthalenone, 2,2-dibromo-3,4-dihydro-, 1(2H)-Naphthalenone,2-dibromo-3,4-dihydro-
| Molecular Formula | C10H8Br2O |
|---|---|
| Molecular Weight | 301.89 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 301.8942 |
| Heavy Atoms | 13 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 51114-70-6 |
|---|---|
| SMILES | C1CC(C(=O)C2=CC=CC=C21)(Br)Br |
| InChIKey | XJUWICWPKZOCJP-UHFFFAOYSA-N |
Product Overview
2,2-Dibromo-3,4-dihydronaphthalen-1(2H)-one (CAS 51114-70-6), with molecular formula C10H8Br2O and molecular weight 301.89 g/mol. IUPAC: 2,2-dibromo-3,4-dihydronaphthalen-1-one.
Chemical Property Profile of 2,2-Dibromo-3,4-dihydronaphthalen-1(2H)-one
Property Insights of 2,2-Dibromo-3,4-dihydronaphthalen-1(2H)-one
The XLogP value of 3.6 indicates that 2,2-Dibromo-3,4-dihydronaphthalen-1(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2,2-Dibromo-3,4-dihydronaphthalen-1(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Dibromo-3,4-dihydronaphthalen-1(2H)-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 2,2-Dibromo-3,4-dihydronaphthalen-1(2H)-one?
The CAS number of 2,2-Dibromo-3,4-dihydronaphthalen-1(2H)-one is 51114-70-6.
What is the molecular formula of 2,2-Dibromo-3,4-dihydronaphthalen-1(2H)-one?
The molecular formula of 2,2-Dibromo-3,4-dihydronaphthalen-1(2H)-one is C10H8Br2O.
What is the molecular weight of 2,2-Dibromo-3,4-dihydronaphthalen-1(2H)-one?
The molecular weight of 2,2-Dibromo-3,4-dihydronaphthalen-1(2H)-one is 301.89 g/mol.
Where can I buy 2,2-Dibromo-3,4-dihydronaphthalen-1(2H)-one?
You can request a quote for 2,2-Dibromo-3,4-dihydronaphthalen-1(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Dibromo-3,4-dihydronaphthalen-1(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Dibromo-3,4-dihydronaphthalen-1(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.