1-Bromo-2-(1,1-dimethoxyethyl)benzene
TL;DR: 1-Bromo-2-(1,1-dimethoxyethyl)benzene (CAS 120254-80-0) is a chemical compound with molecular formula C10H13BrO2 and molecular weight 244.00989 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-bromo-2-(1,1-dimethoxyethyl)benzene
Also Known As: 2'-Bromoacetophenone dimethyl ketal, 1-bromo-2-(1,1-dimethoxyethyl)benzene, o-bromoacetophenone dimethyl ketal, 2 -Bromoacetophenone dimethyl acetal, 2'-Bromoacetophenone dimethyl ketal, 95%
Technical Specifications
| Molecular Formula | C10H13BrO2 |
| Molecular Weight | 244.00989 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.00989 Da |
| Heavy Atoms | 13 |
| Complexity | 157.0 |
| SMILES | CC(C1=CC=CC=C1Br)(OC)OC |
| InChIKey | UYNFQWFFNQBNCL-UHFFFAOYSA-N |
Chemical Property Profile of 1-Bromo-2-(1,1-dimethoxyethyl)benzene
Property Insights of 1-Bromo-2-(1,1-dimethoxyethyl)benzene
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Bromo-2-(1,1-dimethoxyethyl)benzene. With a topological polar surface area (TPSA) of 18.5 Ų, 1-Bromo-2-(1,1-dimethoxyethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-2-(1,1-dimethoxyethyl)benzene has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Bromo-2-(1,1-dimethoxyethyl)benzene?
The CAS number of 1-Bromo-2-(1,1-dimethoxyethyl)benzene is 120254-80-0.
What is the molecular formula of 1-Bromo-2-(1,1-dimethoxyethyl)benzene?
The molecular formula of 1-Bromo-2-(1,1-dimethoxyethyl)benzene is C10H13BrO2.
What is the molecular weight of 1-Bromo-2-(1,1-dimethoxyethyl)benzene?
The molecular weight of 1-Bromo-2-(1,1-dimethoxyethyl)benzene is 244.00989 g/mol.
Where can I buy 1-Bromo-2-(1,1-dimethoxyethyl)benzene?
You can request a quote for 1-Bromo-2-(1,1-dimethoxyethyl)benzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Bromo-2-(1,1-dimethoxyethyl)benzene?
Yes, CoreyChem provides custom synthesis services for 1-Bromo-2-(1,1-dimethoxyethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.