2H-benzotriazole;octadec-9-enoic acid
TL;DR: 2H-benzotriazole;octadec-9-enoic acid (CAS 64653-97-0) is a chemical compound with molecular formula C24H39N3O2 and molecular weight 401.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2H-benzotriazole;octadec-9-enoic acid
Also Known As: Oleic acid, benzotriazole salt, Oleic acid, compound with 1H-benzotriazole, 9-Octadecenoic acid (9Z)-, compd. with 1H-benzotriazole, 9-Octadecenoic acid (Z)-, compd. with 1H-benzotriazole, 9-Octadecenoic acid, (Z)-, compound with 1H-benzotriazole
| Molecular Formula | C24H39N3O2 |
|---|---|
| Molecular Weight | 401.30 g/mol |
| LogP | 7.0664 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 15 |
| Exact Mass | 401.30423 |
| Heavy Atoms | 29 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 64653-97-0 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCC(=O)O.C1=CC2=NNN=C2C=C1 |
| InChIKey | FNPOUUYXQRTDRX-UHFFFAOYSA-N |
Product Overview
2H-benzotriazole;octadec-9-enoic acid (CAS 64653-97-0), with molecular formula C24H39N3O2 and molecular weight 401.30 g/mol. IUPAC: 2H-benzotriazole;octadec-9-enoic acid.
Chemical Property Profile of 2H-benzotriazole;octadec-9-enoic acid
Property Insights of 2H-benzotriazole;octadec-9-enoic acid
The XLogP value of 7.0664 indicates that 2H-benzotriazole;octadec-9-enoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-benzotriazole;octadec-9-enoic acid. Following Lipinski's Rule of Five, 2H-benzotriazole;octadec-9-enoic acid has 2 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 2H-benzotriazole;octadec-9-enoic acid?
The CAS number of 2H-benzotriazole;octadec-9-enoic acid is 64653-97-0.
What is the molecular formula of 2H-benzotriazole;octadec-9-enoic acid?
The molecular formula of 2H-benzotriazole;octadec-9-enoic acid is C24H39N3O2.
What is the molecular weight of 2H-benzotriazole;octadec-9-enoic acid?
The molecular weight of 2H-benzotriazole;octadec-9-enoic acid is 401.30 g/mol.
Where can I buy 2H-benzotriazole;octadec-9-enoic acid?
You can request a quote for 2H-benzotriazole;octadec-9-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-benzotriazole;octadec-9-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2H-benzotriazole;octadec-9-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.