2-(3-Aminopropyl)aniline dihydrochloride
TL;DR: 2-(3-Aminopropyl)aniline dihydrochloride (CAS 72447-61-1) is a chemical compound with molecular formula C9H16Cl2N2 and molecular weight 222.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-aminopropyl)aniline;dihydrochloride
Also Known As: 2-(3-aminopropyl)aniline dihydrochloride, Benzenepropanamine, 2-amino-, dihydrochloride, 2-(3-aminopropyl)aniline,dihydrochloride, 2-(3-aminopropyl)aniline;dihydrochloride, 2-(3-Aminopropyl)aniline--hydrogen chloride (1/2)
| Molecular Formula | C9H16Cl2N2 |
|---|---|
| Molecular Weight | 222.07 g/mol |
| LogP | 2.0037 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 222.06906 |
| Heavy Atoms | 13 |
| Complexity | 104.0 |
Chemical Identifiers
| CAS Number | 72447-61-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CCCN)N.Cl.Cl |
| InChIKey | AHYHWMMZYNPENL-UHFFFAOYSA-N |
Product Overview
2-(3-Aminopropyl)aniline dihydrochloride (CAS 72447-61-1), with molecular formula C9H16Cl2N2 and molecular weight 222.07 g/mol. IUPAC: 2-(3-aminopropyl)aniline;dihydrochloride.
Chemical Property Profile of 2-(3-Aminopropyl)aniline dihydrochloride
Property Insights of 2-(3-Aminopropyl)aniline dihydrochloride
The XLogP value of 2.0037 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Aminopropyl)aniline dihydrochloride. With a topological polar surface area (TPSA) of 52.0 Ų, 2-(3-Aminopropyl)aniline dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-Aminopropyl)aniline dihydrochloride has 4 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 2-(3-Aminopropyl)aniline dihydrochloride?
The CAS number of 2-(3-Aminopropyl)aniline dihydrochloride is 72447-61-1.
What is the molecular formula of 2-(3-Aminopropyl)aniline dihydrochloride?
The molecular formula of 2-(3-Aminopropyl)aniline dihydrochloride is C9H16Cl2N2.
What is the molecular weight of 2-(3-Aminopropyl)aniline dihydrochloride?
The molecular weight of 2-(3-Aminopropyl)aniline dihydrochloride is 222.07 g/mol.
Where can I buy 2-(3-Aminopropyl)aniline dihydrochloride?
You can request a quote for 2-(3-Aminopropyl)aniline dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Aminopropyl)aniline dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Aminopropyl)aniline dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.