5,5-dimethyl-7,8-dihydro-6H-naphthalene-2-carbaldehyde
TL;DR: 5,5-dimethyl-7,8-dihydro-6H-naphthalene-2-carbaldehyde (CAS 68738-96-5) is a chemical compound with molecular formula C13H16O and molecular weight 188.12012 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5,5-dimethyl-7,8-dihydro-6H-naphthalene-2-carbaldehyde
Also Known As: 5,5-dimethyl-7,8-dihydro-6H-naphthalene-2-carbaldehyde, 2-Naphthalenecarboxaldehyde, octahydro-5,5-dimethyl-
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H16O |
| Molecular Weight | 188.12012 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 188.12012 Da |
| Heavy Atoms | 14 |
| Complexity | 219.0 |
| SMILES | CC1(CCCC2=C1C=CC(=C2)C=O)C |
| InChIKey | RWGORSOHMJJWQB-UHFFFAOYSA-N |
Chemical Property Profile of 5,5-dimethyl-7,8-dihydro-6H-naphthalene-2-carbaldehyde
Property Insights of 5,5-dimethyl-7,8-dihydro-6H-naphthalene-2-carbaldehyde
The XLogP value of 3.6 indicates that 5,5-dimethyl-7,8-dihydro-6H-naphthalene-2-carbaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 5,5-dimethyl-7,8-dihydro-6H-naphthalene-2-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,5-dimethyl-7,8-dihydro-6H-naphthalene-2-carbaldehyde 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 5,5-dimethyl-7,8-dihydro-6H-naphthalene-2-carbaldehyde?
The CAS number of 5,5-dimethyl-7,8-dihydro-6H-naphthalene-2-carbaldehyde is 68738-96-5.
What is the molecular formula of 5,5-dimethyl-7,8-dihydro-6H-naphthalene-2-carbaldehyde?
The molecular formula of 5,5-dimethyl-7,8-dihydro-6H-naphthalene-2-carbaldehyde is C13H16O.
What is the molecular weight of 5,5-dimethyl-7,8-dihydro-6H-naphthalene-2-carbaldehyde?
The molecular weight of 5,5-dimethyl-7,8-dihydro-6H-naphthalene-2-carbaldehyde is 188.12012 g/mol.
Where can I buy 5,5-dimethyl-7,8-dihydro-6H-naphthalene-2-carbaldehyde?
You can request a quote for 5,5-dimethyl-7,8-dihydro-6H-naphthalene-2-carbaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5,5-dimethyl-7,8-dihydro-6H-naphthalene-2-carbaldehyde?
Yes, CoreyChem provides custom synthesis services for 5,5-dimethyl-7,8-dihydro-6H-naphthalene-2-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.