1-Butanol, 2-(((4-chlorophenyl)methyl)amino)-, (2R)-
TL;DR: 1-Butanol, 2-(((4-chlorophenyl)methyl)amino)-, (2R)- (CAS 70218-66-5) is a chemical compound with molecular formula C11H16ClNO and molecular weight 213.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chlorophenyl)methylamino]butan-1-ol
Also Known As: 2-[(4-chlorophenyl)methylamino]butan-1-ol, 2-[(4-chlorobenzyl)amino]-1-butanol, 1-Butanol, 2-(((4-chlorophenyl)methyl)amino)-, (2R)-, 2-[(4-chlorobenzyl)amino]butan-1-ol, 2-{[(4-chlorophenyl)methyl]amino}butan-1-ol
| Molecular Formula | C11H16ClNO |
|---|---|
| Molecular Weight | 213.09 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 213.09204 |
| Heavy Atoms | 14 |
| Complexity | 146.0 |
Chemical Identifiers
| CAS Number | 70218-66-5 |
|---|---|
| SMILES | CCC(CO)NCC1=CC=C(C=C1)Cl |
| InChIKey | MSPQTZWVTYYOJB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Butanol, 2-(((4-chlorophenyl)methyl)amino)-, (2R)- (CAS 70218-66-5), with molecular formula C11H16ClNO and molecular weight 213.09 g/mol. IUPAC: 2-[(4-chlorophenyl)methylamino]butan-1-ol.
Chemical Property Profile of 1-Butanol, 2-(((4-chlorophenyl)methyl)amino)-, (2R)-
Property Insights of 1-Butanol, 2-(((4-chlorophenyl)methyl)amino)-, (2R)-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butanol, 2-(((4-chlorophenyl)methyl)amino)-, (2R)-. With a topological polar surface area (TPSA) of 32.3 Ų, 1-Butanol, 2-(((4-chlorophenyl)methyl)amino)-, (2R)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butanol, 2-(((4-chlorophenyl)methyl)amino)-, (2R)- has 2 hydrogen bond donor(s) and 2 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 1-Butanol, 2-(((4-chlorophenyl)methyl)amino)-, (2R)-?
The CAS number of 1-Butanol, 2-(((4-chlorophenyl)methyl)amino)-, (2R)- is 70218-66-5.
What is the molecular formula of 1-Butanol, 2-(((4-chlorophenyl)methyl)amino)-, (2R)-?
The molecular formula of 1-Butanol, 2-(((4-chlorophenyl)methyl)amino)-, (2R)- is C11H16ClNO.
What is the molecular weight of 1-Butanol, 2-(((4-chlorophenyl)methyl)amino)-, (2R)-?
The molecular weight of 1-Butanol, 2-(((4-chlorophenyl)methyl)amino)-, (2R)- is 213.09 g/mol.
Where can I buy 1-Butanol, 2-(((4-chlorophenyl)methyl)amino)-, (2R)-?
You can request a quote for 1-Butanol, 2-(((4-chlorophenyl)methyl)amino)-, (2R)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butanol, 2-(((4-chlorophenyl)methyl)amino)-, (2R)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Butanol, 2-(((4-chlorophenyl)methyl)amino)-, (2R)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.