Benzenemethanamine, N-butyl-3,5-dichloro-
TL;DR: Benzenemethanamine, N-butyl-3,5-dichloro- (CAS 90390-24-2) is a chemical compound with molecular formula C11H15Cl2N and molecular weight 231.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3,5-dichlorophenyl)methyl]butan-1-amine
Also Known As: Benzylamine der, Benzenemethanamine, N-butyl-3,5-dichloro-, BUTYL[(3,5-DICHLOROPHENYL)METHYL]AMINE, Butyl(3,5-dichlorobenzyl)amine, n-(3,5-Dichlorobenzyl)butan-1-amine
| Molecular Formula | C11H15Cl2N |
|---|---|
| Molecular Weight | 231.06 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 231.05815 |
| Heavy Atoms | 14 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 90390-24-2 |
|---|---|
| SMILES | CCCCNCC1=CC(=CC(=C1)Cl)Cl |
| InChIKey | VUWWKOKHXXHUED-UHFFFAOYSA-N |
Product Overview
Benzenemethanamine, N-butyl-3,5-dichloro- (CAS 90390-24-2), with molecular formula C11H15Cl2N and molecular weight 231.06 g/mol. IUPAC: N-[(3,5-dichlorophenyl)methyl]butan-1-amine.
Chemical Property Profile of Benzenemethanamine, N-butyl-3,5-dichloro-
Property Insights of Benzenemethanamine, N-butyl-3,5-dichloro-
The XLogP value of 3.8 indicates that Benzenemethanamine, N-butyl-3,5-dichloro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, Benzenemethanamine, N-butyl-3,5-dichloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenemethanamine, N-butyl-3,5-dichloro- has 1 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 Benzenemethanamine, N-butyl-3,5-dichloro-?
The CAS number of Benzenemethanamine, N-butyl-3,5-dichloro- is 90390-24-2.
What is the molecular formula of Benzenemethanamine, N-butyl-3,5-dichloro-?
The molecular formula of Benzenemethanamine, N-butyl-3,5-dichloro- is C11H15Cl2N.
What is the molecular weight of Benzenemethanamine, N-butyl-3,5-dichloro-?
The molecular weight of Benzenemethanamine, N-butyl-3,5-dichloro- is 231.06 g/mol.
Where can I buy Benzenemethanamine, N-butyl-3,5-dichloro-?
You can request a quote for Benzenemethanamine, N-butyl-3,5-dichloro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenemethanamine, N-butyl-3,5-dichloro-?
Yes, KEHONG BIO provides custom synthesis services for Benzenemethanamine, N-butyl-3,5-dichloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.