Benzhydrol, alpha-(2-(dimethylamino)-1-methylethyl)-, benzoate
TL;DR: Benzhydrol, alpha-(2-(dimethylamino)-1-methylethyl)-, benzoate (CAS 4071-30-1) is a chemical compound with molecular formula C25H27NO2 and molecular weight 373.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(dimethylamino)-2-methyl-1,1-diphenylpropyl] benzoate
Also Known As: 1-Benzoyloxy-3-dimethylamino-1,1-diphenyl-2-methylpropane, Benzhydrol, alpha-(2-(dimethylamino)-1-methylethyl)-, benzoate, alpha-(2-(Dimethylamino)-1-methylethyl)benzhydrol benzoate, 1-Propanol, 3-dimethylamino-1,1-diphenyl-2-methyl-, benzoate, 3-(dimethylamino)-2-methyl-1,1-diphenylpropyl benzoate
| Molecular Formula | C25H27NO2 |
|---|---|
| Molecular Weight | 373.20 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 373.2042 |
| Heavy Atoms | 28 |
| Complexity | 453.0 |
Chemical Identifiers
| CAS Number | 4071-30-1 |
|---|---|
| SMILES | CC(CN(C)C)C(C1=CC=CC=C1)(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3 |
| InChIKey | UHBPWMGWCTWIFE-UHFFFAOYSA-N |
Product Overview
Benzhydrol, alpha-(2-(dimethylamino)-1-methylethyl)-, benzoate (CAS 4071-30-1), with molecular formula C25H27NO2 and molecular weight 373.20 g/mol. IUPAC: [3-(dimethylamino)-2-methyl-1,1-diphenylpropyl] benzoate.
Chemical Property Profile of Benzhydrol, alpha-(2-(dimethylamino)-1-methylethyl)-, benzoate
Property Insights of Benzhydrol, alpha-(2-(dimethylamino)-1-methylethyl)-, benzoate
The XLogP value of 5.6 indicates that Benzhydrol, alpha-(2-(dimethylamino)-1-methylethyl)-, benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Benzhydrol, alpha-(2-(dimethylamino)-1-methylethyl)-, benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzhydrol, alpha-(2-(dimethylamino)-1-methylethyl)-, benzoate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzhydrol, alpha-(2-(dimethylamino)-1-methylethyl)-, benzoate?
The CAS number of Benzhydrol, alpha-(2-(dimethylamino)-1-methylethyl)-, benzoate is 4071-30-1.
What is the molecular formula of Benzhydrol, alpha-(2-(dimethylamino)-1-methylethyl)-, benzoate?
The molecular formula of Benzhydrol, alpha-(2-(dimethylamino)-1-methylethyl)-, benzoate is C25H27NO2.
What is the molecular weight of Benzhydrol, alpha-(2-(dimethylamino)-1-methylethyl)-, benzoate?
The molecular weight of Benzhydrol, alpha-(2-(dimethylamino)-1-methylethyl)-, benzoate is 373.20 g/mol.
Where can I buy Benzhydrol, alpha-(2-(dimethylamino)-1-methylethyl)-, benzoate?
You can request a quote for Benzhydrol, alpha-(2-(dimethylamino)-1-methylethyl)-, benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzhydrol, alpha-(2-(dimethylamino)-1-methylethyl)-, benzoate?
Yes, KEHONG BIO provides custom synthesis services for Benzhydrol, alpha-(2-(dimethylamino)-1-methylethyl)-, benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.