2,4,5-Trimethylphenyl azide
TL;DR: 2,4,5-Trimethylphenyl azide (CAS 147647-81-2) is a chemical compound with molecular formula C9H11N3 and molecular weight 161.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-azido-2,4,5-trimethylbenzene
Also Known As: 2,4,5-Trimethylphenyl azide, 2,4,5-Trimethylphenylazide, 1-azido-2,4,5-trimethylbenzene, Benzene,1-azido-2,4,5-trimethyl-, RefChem:245593
| Molecular Formula | C9H11N3 |
|---|---|
| Molecular Weight | 161.10 g/mol |
| LogP | 3.55366 |
| Topological Polar Surface Area | 48.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 161.09529 |
| Heavy Atoms | 12 |
| Complexity | 349.03644 |
Chemical Identifiers
| CAS Number | 147647-81-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1C)N=[N+]=[N-])C |
Product Overview
2,4,5-Trimethylphenyl azide (CAS 147647-81-2), with molecular formula C9H11N3 and molecular weight 161.10 g/mol. IUPAC: 1-azido-2,4,5-trimethylbenzene.
Chemical Property Profile of 2,4,5-Trimethylphenyl azide
Property Insights of 2,4,5-Trimethylphenyl azide
The XLogP value of 3.55366 indicates that 2,4,5-Trimethylphenyl azide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.76 Ų, 2,4,5-Trimethylphenyl azide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,5-Trimethylphenyl azide has 0 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 2,4,5-Trimethylphenyl azide?
The CAS number of 2,4,5-Trimethylphenyl azide is 147647-81-2.
What is the molecular formula of 2,4,5-Trimethylphenyl azide?
The molecular formula of 2,4,5-Trimethylphenyl azide is C9H11N3.
What is the molecular weight of 2,4,5-Trimethylphenyl azide?
The molecular weight of 2,4,5-Trimethylphenyl azide is 161.10 g/mol.
Where can I buy 2,4,5-Trimethylphenyl azide?
You can request a quote for 2,4,5-Trimethylphenyl azide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,5-Trimethylphenyl azide?
Yes, KEHONG BIO provides custom synthesis services for 2,4,5-Trimethylphenyl azide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.