2(1H)-Naphthalenone, 3,4,5,6,7,8-hexahydro-1,1-dimethyl-
TL;DR: 2(1H)-Naphthalenone, 3,4,5,6,7,8-hexahydro-1,1-dimethyl- (CAS 1609-25-2) is a chemical compound with molecular formula C12H18O and molecular weight 178.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-dimethyl-3,4,5,6,7,8-hexahydronaphthalen-2-one
Also Known As: 1,1-dimethyl-3,4,5,6,7,8-hexahydronaphthalen-2-one, 2(1H)-Naphthalenone, 3,4,5,6,7,8-hexahydro-1,1-dimethyl-, 1,1-Dimethyl-3,4,5,6,7,8-hexahydronaphthalene-2(1H)-one, 3,4,5,6,7,8-Hexahydro-1,1-dimethyl-2(1H)-naphthalenone, 1,1-dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalen-2-one
| Molecular Formula | C12H18O |
|---|---|
| Molecular Weight | 178.14 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 178.13577 |
| Heavy Atoms | 13 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 1609-25-2 |
|---|---|
| SMILES | CC1(C2=C(CCCC2)CCC1=O)C |
| InChIKey | LQOBSLHZHXWKAO-UHFFFAOYSA-N |
Product Overview
2(1H)-Naphthalenone, 3,4,5,6,7,8-hexahydro-1,1-dimethyl- (CAS 1609-25-2), with molecular formula C12H18O and molecular weight 178.14 g/mol. IUPAC: 1,1-dimethyl-3,4,5,6,7,8-hexahydronaphthalen-2-one.
Chemical Property Profile of 2(1H)-Naphthalenone, 3,4,5,6,7,8-hexahydro-1,1-dimethyl-
Property Insights of 2(1H)-Naphthalenone, 3,4,5,6,7,8-hexahydro-1,1-dimethyl-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2(1H)-Naphthalenone, 3,4,5,6,7,8-hexahydro-1,1-dimethyl-. With a topological polar surface area (TPSA) of 17.1 Ų, 2(1H)-Naphthalenone, 3,4,5,6,7,8-hexahydro-1,1-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2(1H)-Naphthalenone, 3,4,5,6,7,8-hexahydro-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
Frequently Asked Questions
What is the CAS number of 2(1H)-Naphthalenone, 3,4,5,6,7,8-hexahydro-1,1-dimethyl-?
The CAS number of 2(1H)-Naphthalenone, 3,4,5,6,7,8-hexahydro-1,1-dimethyl- is 1609-25-2.
What is the molecular formula of 2(1H)-Naphthalenone, 3,4,5,6,7,8-hexahydro-1,1-dimethyl-?
The molecular formula of 2(1H)-Naphthalenone, 3,4,5,6,7,8-hexahydro-1,1-dimethyl- is C12H18O.
What is the molecular weight of 2(1H)-Naphthalenone, 3,4,5,6,7,8-hexahydro-1,1-dimethyl-?
The molecular weight of 2(1H)-Naphthalenone, 3,4,5,6,7,8-hexahydro-1,1-dimethyl- is 178.14 g/mol.
Where can I buy 2(1H)-Naphthalenone, 3,4,5,6,7,8-hexahydro-1,1-dimethyl-?
You can request a quote for 2(1H)-Naphthalenone, 3,4,5,6,7,8-hexahydro-1,1-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2(1H)-Naphthalenone, 3,4,5,6,7,8-hexahydro-1,1-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 2(1H)-Naphthalenone, 3,4,5,6,7,8-hexahydro-1,1-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.