2-Benzyl-4,4-dimethylnaphthalen-1(4h)-one
TL;DR: 2-Benzyl-4,4-dimethylnaphthalen-1(4h)-one (CAS 427-30-5) is a chemical compound with molecular formula C19H18O and molecular weight 262.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzyl-4,4-dimethylnaphthalen-1-one
Also Known As: 2-benzyl-4,4-dimethylnaphthalen-1(4h)-one, 2-benzyl-4,4-dimethylnaphthalen-1-one, 2-benzyl-4,4-dimethyl-1(4H)-naphthalenone, 2-Benzyl-4,4-dimethyl-1-keto-1,4-dihydro-naphthalin
| Molecular Formula | C19H18O |
|---|---|
| Molecular Weight | 262.14 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.13577 |
| Heavy Atoms | 20 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 427-30-5 |
|---|---|
| SMILES | CC1(C=C(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3)C |
| InChIKey | WAQYTHYDVRWTDW-UHFFFAOYSA-N |
Product Overview
2-Benzyl-4,4-dimethylnaphthalen-1(4h)-one (CAS 427-30-5), with molecular formula C19H18O and molecular weight 262.14 g/mol. IUPAC: 2-benzyl-4,4-dimethylnaphthalen-1-one.
Chemical Property Profile of 2-Benzyl-4,4-dimethylnaphthalen-1(4h)-one
Property Insights of 2-Benzyl-4,4-dimethylnaphthalen-1(4h)-one
The XLogP value of 5.0 indicates that 2-Benzyl-4,4-dimethylnaphthalen-1(4h)-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-Benzyl-4,4-dimethylnaphthalen-1(4h)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzyl-4,4-dimethylnaphthalen-1(4h)-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-Benzyl-4,4-dimethylnaphthalen-1(4h)-one?
The CAS number of 2-Benzyl-4,4-dimethylnaphthalen-1(4h)-one is 427-30-5.
What is the molecular formula of 2-Benzyl-4,4-dimethylnaphthalen-1(4h)-one?
The molecular formula of 2-Benzyl-4,4-dimethylnaphthalen-1(4h)-one is C19H18O.
What is the molecular weight of 2-Benzyl-4,4-dimethylnaphthalen-1(4h)-one?
The molecular weight of 2-Benzyl-4,4-dimethylnaphthalen-1(4h)-one is 262.14 g/mol.
Where can I buy 2-Benzyl-4,4-dimethylnaphthalen-1(4h)-one?
You can request a quote for 2-Benzyl-4,4-dimethylnaphthalen-1(4h)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzyl-4,4-dimethylnaphthalen-1(4h)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzyl-4,4-dimethylnaphthalen-1(4h)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.