1-(4-Butyltriazol-1-yl)ethanone
TL;DR: 1-(4-Butyltriazol-1-yl)ethanone (CAS 19232-32-7) is a chemical compound with molecular formula C8H13N3O and molecular weight 167.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-butyltriazol-1-yl)ethanone
Also Known As: 1-(4-butyltriazol-1-yl)ethanone, 1-(4-Butyl-1H-1,2,3-triazol-1-yl)ethan-1-one
| Molecular Formula | C8H13N3O |
|---|---|
| Molecular Weight | 167.11 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 47.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 167.10587 |
| Heavy Atoms | 12 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 19232-32-7 |
|---|---|
| SMILES | CCCCC1=CN(N=N1)C(=O)C |
| InChIKey | HBGZORCNNUJETM-UHFFFAOYSA-N |
Product Overview
1-(4-Butyltriazol-1-yl)ethanone (CAS 19232-32-7), with molecular formula C8H13N3O and molecular weight 167.11 g/mol. IUPAC: 1-(4-butyltriazol-1-yl)ethanone.
Chemical Property Profile of 1-(4-Butyltriazol-1-yl)ethanone
Property Insights of 1-(4-Butyltriazol-1-yl)ethanone
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Butyltriazol-1-yl)ethanone. With a topological polar surface area (TPSA) of 47.8 Ų, 1-(4-Butyltriazol-1-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Butyltriazol-1-yl)ethanone has 0 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 1-(4-Butyltriazol-1-yl)ethanone?
The CAS number of 1-(4-Butyltriazol-1-yl)ethanone is 19232-32-7.
What is the molecular formula of 1-(4-Butyltriazol-1-yl)ethanone?
The molecular formula of 1-(4-Butyltriazol-1-yl)ethanone is C8H13N3O.
What is the molecular weight of 1-(4-Butyltriazol-1-yl)ethanone?
The molecular weight of 1-(4-Butyltriazol-1-yl)ethanone is 167.11 g/mol.
Where can I buy 1-(4-Butyltriazol-1-yl)ethanone?
You can request a quote for 1-(4-Butyltriazol-1-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Butyltriazol-1-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Butyltriazol-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.