![Phenyl 5-benzo[e]benzotriazol-2-yl-2-(2-phenylethenyl)benzenesulfonate structure](/static/products/6994/6994-51-0.webp)
Phenyl 5-benzo[e]benzotriazol-2-yl-2-(2-phenylethenyl)benzenesulfonate
TL;DR: Phenyl 5-benzo[e]benzotriazol-2-yl-2-(2-phenylethenyl)benzenesulfonate (CAS 6994-51-0) is a chemical compound with molecular formula C30H21N3O3S and molecular weight 503.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl 5-benzo[e]benzotriazol-2-yl-2-(2-phenylethenyl)benzenesulfonate
Also Known As: BAS 00112048, phenyl 5-benzo[e]benzotriazol-2-yl-2-(2-phenylethenyl)benzenesulfonate, Benzenesulfonic acid,5-(2H-naphtho[1,2-d]triazol-2-yl)-2-(2-phenylethenyl)-, phenyl ester, Benzenesulfonic acid, 5-(2H-naphtho[1,2-d]triazol-2-yl)-2-(2-phenylethenyl)-, phenyl ester
| Molecular Formula | C30H21N3O3S |
|---|---|
| Molecular Weight | 503.13 g/mol |
| LogP | 7.9 |
| Topological Polar Surface Area | 82.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 503.13037 |
| Heavy Atoms | 37 |
| Complexity | 877.0 |
Chemical Identifiers
| CAS Number | 6994-51-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=CC2=C(C=C(C=C2)N3N=C4C=CC5=CC=CC=C5C4=N3)S(=O)(=O)OC6=CC=CC=C6 |
| InChIKey | UVLVTQUZKGNXQB-UHFFFAOYSA-N |
Product Overview
Phenyl 5-benzo[e]benzotriazol-2-yl-2-(2-phenylethenyl)benzenesulfonate (CAS 6994-51-0), with molecular formula C30H21N3O3S and molecular weight 503.13 g/mol. IUPAC: phenyl 5-benzo[e]benzotriazol-2-yl-2-(2-phenylethenyl)benzenesulfonate.
Chemical Property Profile of Phenyl 5-benzo[e]benzotriazol-2-yl-2-(2-phenylethenyl)benzenesulfonate
Property Insights of Phenyl 5-benzo[e]benzotriazol-2-yl-2-(2-phenylethenyl)benzenesulfonate
The XLogP value of 7.9 indicates that Phenyl 5-benzo[e]benzotriazol-2-yl-2-(2-phenylethenyl)benzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenyl 5-benzo[e]benzotriazol-2-yl-2-(2-phenylethenyl)benzenesulfonate. Following Lipinski's Rule of Five, Phenyl 5-benzo[e]benzotriazol-2-yl-2-(2-phenylethenyl)benzenesulfonate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phenyl 5-benzo[e]benzotriazol-2-yl-2-(2-phenylethenyl)benzenesulfonate?
The CAS number of Phenyl 5-benzo[e]benzotriazol-2-yl-2-(2-phenylethenyl)benzenesulfonate is 6994-51-0.
What is the molecular formula of Phenyl 5-benzo[e]benzotriazol-2-yl-2-(2-phenylethenyl)benzenesulfonate?
The molecular formula of Phenyl 5-benzo[e]benzotriazol-2-yl-2-(2-phenylethenyl)benzenesulfonate is C30H21N3O3S.
What is the molecular weight of Phenyl 5-benzo[e]benzotriazol-2-yl-2-(2-phenylethenyl)benzenesulfonate?
The molecular weight of Phenyl 5-benzo[e]benzotriazol-2-yl-2-(2-phenylethenyl)benzenesulfonate is 503.13 g/mol.
Where can I buy Phenyl 5-benzo[e]benzotriazol-2-yl-2-(2-phenylethenyl)benzenesulfonate?
You can request a quote for Phenyl 5-benzo[e]benzotriazol-2-yl-2-(2-phenylethenyl)benzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl 5-benzo[e]benzotriazol-2-yl-2-(2-phenylethenyl)benzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Phenyl 5-benzo[e]benzotriazol-2-yl-2-(2-phenylethenyl)benzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.