2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methyl-1H-benzimidazole-5-carboxylate
TL;DR: 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methyl-1H-benzimidazole-5-carboxylate (CAS 121311-10-2) is a chemical compound with molecular formula C18H14F12N2O2 and molecular weight 518.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methylbenzimidazole-5-carboxylate
Also Known As: 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methyl-1H-benzimidazole-5-carboxylate, 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methylbenzimidazole-5-carboxylate, 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methyl-1H-benzo[d]imidazole-5-carboxylate
| Molecular Formula | C18H14F12N2O2 |
|---|---|
| Molecular Weight | 518.09 g/mol |
| LogP | 5.96302 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 518.08636 |
| Heavy Atoms | 34 |
| Complexity | 1064.6263 |
Chemical Identifiers
| CAS Number | 121311-10-2 |
|---|---|
| SMILES | CCN1C(=NC2=C1C=CC(=C2)C(=O)OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C |
Product Overview
2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methyl-1H-benzimidazole-5-carboxylate (CAS 121311-10-2), with molecular formula C18H14F12N2O2 and molecular weight 518.09 g/mol. IUPAC: 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methylbenzimidazole-5-carboxylate.
Chemical Property Profile of 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methyl-1H-benzimidazole-5-carboxylate
Property Insights of 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methyl-1H-benzimidazole-5-carboxylate
The XLogP value of 5.96302 indicates that 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methyl-1H-benzimidazole-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.12 Ų, 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methyl-1H-benzimidazole-5-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methyl-1H-benzimidazole-5-carboxylate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methyl-1H-benzimidazole-5-carboxylate?
The CAS number of 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methyl-1H-benzimidazole-5-carboxylate is 121311-10-2.
What is the molecular formula of 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methyl-1H-benzimidazole-5-carboxylate?
The molecular formula of 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methyl-1H-benzimidazole-5-carboxylate is C18H14F12N2O2.
What is the molecular weight of 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methyl-1H-benzimidazole-5-carboxylate?
The molecular weight of 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methyl-1H-benzimidazole-5-carboxylate is 518.09 g/mol.
Where can I buy 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methyl-1H-benzimidazole-5-carboxylate?
You can request a quote for 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methyl-1H-benzimidazole-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methyl-1H-benzimidazole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 1-ethyl-2-methyl-1H-benzimidazole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.