1-Prop-1-enylbenzotriazole
TL;DR: 1-Prop-1-enylbenzotriazole (CAS 23310-20-5) is a chemical compound with molecular formula C9H9N3 and molecular weight 159.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-prop-1-enylbenzotriazole
Also Known As: 1-prop-1-enylbenzotriazole, 1-(propenyl)benzotriazole
| Molecular Formula | C9H9N3 |
|---|---|
| Molecular Weight | 159.08 g/mol |
| LogP | 1.9219 |
| Topological Polar Surface Area | 30.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 159.07965 |
| Heavy Atoms | 12 |
| Complexity | 414.3858 |
Chemical Identifiers
| CAS Number | 23310-20-5 |
|---|---|
| SMILES | CC=CN1C2=CC=CC=C2N=N1 |
Product Overview
1-Prop-1-enylbenzotriazole (CAS 23310-20-5), with molecular formula C9H9N3 and molecular weight 159.08 g/mol. IUPAC: 1-prop-1-enylbenzotriazole.
Chemical Property Profile of 1-Prop-1-enylbenzotriazole
Property Insights of 1-Prop-1-enylbenzotriazole
The XLogP value of 1.9219 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Prop-1-enylbenzotriazole. With a topological polar surface area (TPSA) of 30.71 Ų, 1-Prop-1-enylbenzotriazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Prop-1-enylbenzotriazole has 0 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-Prop-1-enylbenzotriazole?
The CAS number of 1-Prop-1-enylbenzotriazole is 23310-20-5.
What is the molecular formula of 1-Prop-1-enylbenzotriazole?
The molecular formula of 1-Prop-1-enylbenzotriazole is C9H9N3.
What is the molecular weight of 1-Prop-1-enylbenzotriazole?
The molecular weight of 1-Prop-1-enylbenzotriazole is 159.08 g/mol.
Where can I buy 1-Prop-1-enylbenzotriazole?
You can request a quote for 1-Prop-1-enylbenzotriazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Prop-1-enylbenzotriazole?
Yes, KEHONG BIO provides custom synthesis services for 1-Prop-1-enylbenzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.