4-(p-ethoxyphenyl)hexahydroacetophenone
TL;DR: 4-(p-ethoxyphenyl)hexahydroacetophenone (CAS 100073-56-1) is a chemical compound with molecular formula C16H23NO and molecular weight 245.17796 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(propan-2-ylamino)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)propan-1-one
Also Known As: 4-(p-ethoxyphenyl)hexahydroacetophenone, AB00084281-01, 2-(propan-2-ylamino)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)propan-1-one, 1-<6-(1,2,3,4-tetrahydro)naphthyl>-2-isopropylaminopropanone hydrochloride, 2-Isopropylamino-1-(5,6,7,8-tetrahydro-naphthalen-2-yl)-propan-1-one
Technical Specifications
| Molecular Formula | C16H23NO |
| Molecular Weight | 245.17796 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 245.17796 Da |
| Heavy Atoms | 18 |
| Complexity | 287.0 |
| SMILES | CC(C)NC(C)C(=O)C1=CC2=C(CCCC2)C=C1 |
| InChIKey | NIKRIWIMZPNPQP-UHFFFAOYSA-N |
Chemical Property Profile of 4-(p-ethoxyphenyl)hexahydroacetophenone
Property Insights of 4-(p-ethoxyphenyl)hexahydroacetophenone
The XLogP value of 3.8 indicates that 4-(p-ethoxyphenyl)hexahydroacetophenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 4-(p-ethoxyphenyl)hexahydroacetophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(p-ethoxyphenyl)hexahydroacetophenone has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(p-ethoxyphenyl)hexahydroacetophenone?
The CAS number of 4-(p-ethoxyphenyl)hexahydroacetophenone is 100073-56-1.
What is the molecular formula of 4-(p-ethoxyphenyl)hexahydroacetophenone?
The molecular formula of 4-(p-ethoxyphenyl)hexahydroacetophenone is C16H23NO.
What is the molecular weight of 4-(p-ethoxyphenyl)hexahydroacetophenone?
The molecular weight of 4-(p-ethoxyphenyl)hexahydroacetophenone is 245.17796 g/mol.
Where can I buy 4-(p-ethoxyphenyl)hexahydroacetophenone?
You can request a quote for 4-(p-ethoxyphenyl)hexahydroacetophenone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(p-ethoxyphenyl)hexahydroacetophenone?
Yes, CoreyChem provides custom synthesis services for 4-(p-ethoxyphenyl)hexahydroacetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.