3-(Benzotriazol-1-yl)propan-1-amine
TL;DR: 3-(Benzotriazol-1-yl)propan-1-amine (CAS 73866-19-0) is a chemical compound with molecular formula C9H12N4 and molecular weight 176.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(benzotriazol-1-yl)propan-1-amine
Also Known As: 3-(benzotriazol-1-yl)propan-1-amine, 1H-Benzotriazole-1-propanamine, CHEMBRDG-BB4004264, CHEMBRDG-BB 4004264, 3-benzotriazol-1-ylpropan-1-amine
| Molecular Formula | C9H12N4 |
|---|---|
| Molecular Weight | 176.11 g/mol |
| LogP | 0.7801 |
| Topological Polar Surface Area | 56.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 176.1062 |
| Heavy Atoms | 13 |
| Complexity | 393.16898 |
Chemical Identifiers
| CAS Number | 73866-19-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=NN2CCCN |
Product Overview
3-(Benzotriazol-1-yl)propan-1-amine (CAS 73866-19-0), with molecular formula C9H12N4 and molecular weight 176.11 g/mol. IUPAC: 3-(benzotriazol-1-yl)propan-1-amine.
Chemical Property Profile of 3-(Benzotriazol-1-yl)propan-1-amine
Property Insights of 3-(Benzotriazol-1-yl)propan-1-amine
The XLogP value of 0.7801 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Benzotriazol-1-yl)propan-1-amine. With a topological polar surface area (TPSA) of 56.73 Ų, 3-(Benzotriazol-1-yl)propan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Benzotriazol-1-yl)propan-1-amine has 1 hydrogen bond donor(s) and 3 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 3-(Benzotriazol-1-yl)propan-1-amine?
The CAS number of 3-(Benzotriazol-1-yl)propan-1-amine is 73866-19-0.
What is the molecular formula of 3-(Benzotriazol-1-yl)propan-1-amine?
The molecular formula of 3-(Benzotriazol-1-yl)propan-1-amine is C9H12N4.
What is the molecular weight of 3-(Benzotriazol-1-yl)propan-1-amine?
The molecular weight of 3-(Benzotriazol-1-yl)propan-1-amine is 176.11 g/mol.
Where can I buy 3-(Benzotriazol-1-yl)propan-1-amine?
You can request a quote for 3-(Benzotriazol-1-yl)propan-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Benzotriazol-1-yl)propan-1-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-(Benzotriazol-1-yl)propan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.