2-(2H-benzotriazol-2-yl)-4-methylphenyl diphenylacetate
TL;DR: 2-(2H-benzotriazol-2-yl)-4-methylphenyl diphenylacetate (CAS 300690-62-4) is a chemical compound with molecular formula C27H21N3O2 and molecular weight 419.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(benzotriazol-2-yl)-4-methylphenyl] 2,2-diphenylacetate
Also Known As: BAS 00127766, 2-(2H-benzotriazol-2-yl)-4-methylphenyl diphenylacetate, [2-(benzotriazol-2-yl)-4-methylphenyl] 2,2-diphenylacetate, 2-(2H-benzo[d][1,2,3]triazol-2-yl)-4-methylphenyl 2,2-diphenylacetate, Diphenyl-acetic acid 2-benzotriazol-2-yl-4-methyl-phenyl ester
| Molecular Formula | C27H21N3O2 |
|---|---|
| Molecular Weight | 419.16 g/mol |
| LogP | 5.46642 |
| Topological Polar Surface Area | 57.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 419.1634 |
| Heavy Atoms | 32 |
| Complexity | 1305.7448 |
Chemical Identifiers
| CAS Number | 300690-62-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)N4N=C5C=CC=CC5=N4 |
Product Overview
2-(2H-benzotriazol-2-yl)-4-methylphenyl diphenylacetate (CAS 300690-62-4), with molecular formula C27H21N3O2 and molecular weight 419.16 g/mol. IUPAC: [2-(benzotriazol-2-yl)-4-methylphenyl] 2,2-diphenylacetate.
Chemical Property Profile of 2-(2H-benzotriazol-2-yl)-4-methylphenyl diphenylacetate
Property Insights of 2-(2H-benzotriazol-2-yl)-4-methylphenyl diphenylacetate
The XLogP value of 5.46642 indicates that 2-(2H-benzotriazol-2-yl)-4-methylphenyl diphenylacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.01 Ų, 2-(2H-benzotriazol-2-yl)-4-methylphenyl diphenylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2H-benzotriazol-2-yl)-4-methylphenyl diphenylacetate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(2H-benzotriazol-2-yl)-4-methylphenyl diphenylacetate?
The CAS number of 2-(2H-benzotriazol-2-yl)-4-methylphenyl diphenylacetate is 300690-62-4.
What is the molecular formula of 2-(2H-benzotriazol-2-yl)-4-methylphenyl diphenylacetate?
The molecular formula of 2-(2H-benzotriazol-2-yl)-4-methylphenyl diphenylacetate is C27H21N3O2.
What is the molecular weight of 2-(2H-benzotriazol-2-yl)-4-methylphenyl diphenylacetate?
The molecular weight of 2-(2H-benzotriazol-2-yl)-4-methylphenyl diphenylacetate is 419.16 g/mol.
Where can I buy 2-(2H-benzotriazol-2-yl)-4-methylphenyl diphenylacetate?
You can request a quote for 2-(2H-benzotriazol-2-yl)-4-methylphenyl diphenylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2H-benzotriazol-2-yl)-4-methylphenyl diphenylacetate?
Yes, KEHONG BIO provides custom synthesis services for 2-(2H-benzotriazol-2-yl)-4-methylphenyl diphenylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.