2(1H)-Naphthalenone, 3-bromo-1,1-dimethyl-
TL;DR: 2(1H)-Naphthalenone, 3-bromo-1,1-dimethyl- (CAS 105282-76-6) is a chemical compound with molecular formula C12H11BrO and molecular weight 249.99933 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-bromo-1,1-dimethylnaphthalen-2-one
Also Known As: 3-bromo-1,1-dimethylnaphthalen-2-one, 2(1H)-Naphthalenone, 3-bromo-1,1-dimethyl-, 3-Brom-1,1-dimethyl-1H-naphthalin-2-on, 3-Bromo-1,1-dimethylnaphthalen-2(1H)-one
Technical Specifications
| Molecular Formula | C12H11BrO |
| Molecular Weight | 249.99933 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 249.99933 Da |
| Heavy Atoms | 14 |
| Complexity | 291.0 |
| SMILES | CC1(C2=CC=CC=C2C=C(C1=O)Br)C |
| InChIKey | QBWOPDPBMNMCTP-UHFFFAOYSA-N |
Chemical Property Profile of 2(1H)-Naphthalenone, 3-bromo-1,1-dimethyl-
Property Insights of 2(1H)-Naphthalenone, 3-bromo-1,1-dimethyl-
The XLogP value of 3.7 indicates that 2(1H)-Naphthalenone, 3-bromo-1,1-dimethyl- 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(1H)-Naphthalenone, 3-bromo-1,1-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2(1H)-Naphthalenone, 3-bromo-1,1-dimethyl- 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
What is the CAS number of 2(1H)-Naphthalenone, 3-bromo-1,1-dimethyl-?
The CAS number of 2(1H)-Naphthalenone, 3-bromo-1,1-dimethyl- is 105282-76-6.
What is the molecular formula of 2(1H)-Naphthalenone, 3-bromo-1,1-dimethyl-?
The molecular formula of 2(1H)-Naphthalenone, 3-bromo-1,1-dimethyl- is C12H11BrO.
What is the molecular weight of 2(1H)-Naphthalenone, 3-bromo-1,1-dimethyl-?
The molecular weight of 2(1H)-Naphthalenone, 3-bromo-1,1-dimethyl- is 249.99933 g/mol.
Where can I buy 2(1H)-Naphthalenone, 3-bromo-1,1-dimethyl-?
You can request a quote for 2(1H)-Naphthalenone, 3-bromo-1,1-dimethyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2(1H)-Naphthalenone, 3-bromo-1,1-dimethyl-?
Yes, CoreyChem provides custom synthesis services for 2(1H)-Naphthalenone, 3-bromo-1,1-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.