1-(3,8,8-trimethyl-5-propan-2-yl-6,7-dihydro-5H-naphthalen-2-yl)ethanone
TL;DR: 1-(3,8,8-trimethyl-5-propan-2-yl-6,7-dihydro-5H-naphthalen-2-yl)ethanone (CAS 94003-04-0) is a chemical compound with molecular formula C18H26O and molecular weight 258.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,8,8-trimethyl-5-propan-2-yl-6,7-dihydro-5H-naphthalen-2-yl)ethanone
Also Known As: 1-(3,8,8-trimethyl-5-propan-2-yl-6,7-dihydro-5H-naphthalen-2-yl)ethanone, 1-(3,8,8-trimethyl-5-propan-2-yl-6,7-dihydro-5H-naphthalen-2, 1-[3,8,8-Trimethyl-5-(propan-2-yl)-5,6,7,8-tetrahydronaphthalen-2-yl]ethan-1-one, 1-[3,8,8-trimethyl-5-(propan-2-yl)-5,6,7,8-tetrahydronaphthalen-2-yl]ethanone
| Molecular Formula | C18H26O |
|---|---|
| Molecular Weight | 258.20 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 258.19836 |
| Heavy Atoms | 19 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 94003-04-0 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C(=O)C)C(CCC2C(C)C)(C)C |
| InChIKey | JNNQKUSHJQJLFW-UHFFFAOYSA-N |
Product Overview
1-(3,8,8-trimethyl-5-propan-2-yl-6,7-dihydro-5H-naphthalen-2-yl)ethanone (CAS 94003-04-0), with molecular formula C18H26O and molecular weight 258.20 g/mol. IUPAC: 1-(3,8,8-trimethyl-5-propan-2-yl-6,7-dihydro-5H-naphthalen-2-yl)ethanone.
Chemical Property Profile of 1-(3,8,8-trimethyl-5-propan-2-yl-6,7-dihydro-5H-naphthalen-2-yl)ethanone
Property Insights of 1-(3,8,8-trimethyl-5-propan-2-yl-6,7-dihydro-5H-naphthalen-2-yl)ethanone
The XLogP value of 5.3 indicates that 1-(3,8,8-trimethyl-5-propan-2-yl-6,7-dihydro-5H-naphthalen-2-yl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 1-(3,8,8-trimethyl-5-propan-2-yl-6,7-dihydro-5H-naphthalen-2-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,8,8-trimethyl-5-propan-2-yl-6,7-dihydro-5H-naphthalen-2-yl)ethanone has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(3,8,8-trimethyl-5-propan-2-yl-6,7-dihydro-5H-naphthalen-2-yl)ethanone?
The CAS number of 1-(3,8,8-trimethyl-5-propan-2-yl-6,7-dihydro-5H-naphthalen-2-yl)ethanone is 94003-04-0.
What is the molecular formula of 1-(3,8,8-trimethyl-5-propan-2-yl-6,7-dihydro-5H-naphthalen-2-yl)ethanone?
The molecular formula of 1-(3,8,8-trimethyl-5-propan-2-yl-6,7-dihydro-5H-naphthalen-2-yl)ethanone is C18H26O.
What is the molecular weight of 1-(3,8,8-trimethyl-5-propan-2-yl-6,7-dihydro-5H-naphthalen-2-yl)ethanone?
The molecular weight of 1-(3,8,8-trimethyl-5-propan-2-yl-6,7-dihydro-5H-naphthalen-2-yl)ethanone is 258.20 g/mol.
Where can I buy 1-(3,8,8-trimethyl-5-propan-2-yl-6,7-dihydro-5H-naphthalen-2-yl)ethanone?
You can request a quote for 1-(3,8,8-trimethyl-5-propan-2-yl-6,7-dihydro-5H-naphthalen-2-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,8,8-trimethyl-5-propan-2-yl-6,7-dihydro-5H-naphthalen-2-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,8,8-trimethyl-5-propan-2-yl-6,7-dihydro-5H-naphthalen-2-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.