2-Bornanol, 3-(((2-(diethylamino)ethyl)methylamino)methyl)-, benzoate
TL;DR: 2-Bornanol, 3-(((2-(diethylamino)ethyl)methylamino)methyl)-, benzoate (CAS 17093-03-7) is a chemical compound with molecular formula C25H40N2O2 and molecular weight 400.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-[[2-(diethylamino)ethyl-methylamino]methyl]-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] benzoate
Also Known As: 2-Bornanol, 3-(((2-(diethylamino)ethyl)methylamino)methyl)-, benzoate, Benzoato di N-metil,N-(beta-dietilaminoetil)-3-aminometil-2-bornanolo [Italian], Benzoato di N-metil,N-(beta-dietilaminoetil)-3-aminometil-2-bornanolo, Bicyclo(2.2.1)heptan-2-ol, 3-(((2-(diethylamino)ethyl)methylamino)methyl)-1,7,7-trimethyl-, benzoate (ester), [2-[[2-diethylaminoethyl(methyl)amino]methyl]-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] benzoate
| Molecular Formula | C25H40N2O2 |
|---|---|
| Molecular Weight | 400.31 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 400.309 |
| Heavy Atoms | 29 |
| Complexity | 553.0 |
Chemical Identifiers
| CAS Number | 17093-03-7 |
|---|---|
| SMILES | CCN(CC)CCN(C)CC1C2CCC(C1OC(=O)C3=CC=CC=C3)(C2(C)C)C |
| InChIKey | KFXDPIPNZWJVPT-UHFFFAOYSA-N |
Product Overview
2-Bornanol, 3-(((2-(diethylamino)ethyl)methylamino)methyl)-, benzoate (CAS 17093-03-7), with molecular formula C25H40N2O2 and molecular weight 400.31 g/mol. IUPAC: [3-[[2-(diethylamino)ethyl-methylamino]methyl]-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] benzoate.
Chemical Property Profile of 2-Bornanol, 3-(((2-(diethylamino)ethyl)methylamino)methyl)-, benzoate
Property Insights of 2-Bornanol, 3-(((2-(diethylamino)ethyl)methylamino)methyl)-, benzoate
The XLogP value of 5.5 indicates that 2-Bornanol, 3-(((2-(diethylamino)ethyl)methylamino)methyl)-, benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.8 Ų, 2-Bornanol, 3-(((2-(diethylamino)ethyl)methylamino)methyl)-, benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bornanol, 3-(((2-(diethylamino)ethyl)methylamino)methyl)-, benzoate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Bornanol, 3-(((2-(diethylamino)ethyl)methylamino)methyl)-, benzoate?
The CAS number of 2-Bornanol, 3-(((2-(diethylamino)ethyl)methylamino)methyl)-, benzoate is 17093-03-7.
What is the molecular formula of 2-Bornanol, 3-(((2-(diethylamino)ethyl)methylamino)methyl)-, benzoate?
The molecular formula of 2-Bornanol, 3-(((2-(diethylamino)ethyl)methylamino)methyl)-, benzoate is C25H40N2O2.
What is the molecular weight of 2-Bornanol, 3-(((2-(diethylamino)ethyl)methylamino)methyl)-, benzoate?
The molecular weight of 2-Bornanol, 3-(((2-(diethylamino)ethyl)methylamino)methyl)-, benzoate is 400.31 g/mol.
Where can I buy 2-Bornanol, 3-(((2-(diethylamino)ethyl)methylamino)methyl)-, benzoate?
You can request a quote for 2-Bornanol, 3-(((2-(diethylamino)ethyl)methylamino)methyl)-, benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bornanol, 3-(((2-(diethylamino)ethyl)methylamino)methyl)-, benzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Bornanol, 3-(((2-(diethylamino)ethyl)methylamino)methyl)-, benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.