Dim-valeronitrile
TL;DR: Dim-valeronitrile (CAS 124562-84-1) is a chemical compound with molecular formula C29H36F3N5O3 and molecular weight 559.27704 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[4-[2-[[4-cyano-4-(3,4-dimethoxyphenyl)-5-methylhexyl]-methylamino]ethyl]phenyl]-2-diazo-3,3,3-trifluoro-N-methylpropanamide
Also Known As: Dim-valeronitrile, 2-(3,4-dimethoxyphenyl)-2-isopropyl-5-(N-(4-(N-methyl-2-diazo-3,3,3-trifluoropropionamido)phenethyl), 2-(3,4-Dimethoxyphenyl)-2-isopropyl-5-(N-(4-(N-methyl-2-diazo-3,3,3-trifluoropropionamido)phenethyl)methylamino)valeronitrile, N-[4-[2-[[4-cyano-4-(3,4-dimethoxyphenyl)-5-methylhexyl]-methylamino]ethyl]phenyl]-2-diazo-3,3,3-trifluoro-N-methylpropanamide, (Z)-1-[[4-[2-[[4-Cyano-4-(3,4-Dimethoxyphenyl)-5-Methylhexyl]-Methylamino]Ethyl]Phenyl]-Methylamino]-2-Diazonio-3,3,3-Trifluoroprop-1-En-1-Olate
Technical Specifications
| Molecular Formula | C29H36F3N5O3 |
| Molecular Weight | 559.27704 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 67.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 13 |
| Exact Mass | 559.27704 Da |
| Heavy Atoms | 40 |
| Complexity | 922.0 |
| SMILES | CC(C)C(CCCN(C)CCC1=CC=C(C=C1)N(C)C(=O)C(=[N+]=[N-])C(F)(F)F)(C#N)C2=CC(=C(C=C2)OC)OC |
| InChIKey | LSZIVBOIBFXLNT-UHFFFAOYSA-N |
Chemical Property Profile of Dim-valeronitrile
Property Insights of Dim-valeronitrile
The XLogP value of 4.6 indicates that Dim-valeronitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Dim-valeronitrile. Following Lipinski's Rule of Five, Dim-valeronitrile has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Dim-valeronitrile?
The CAS number of Dim-valeronitrile is 124562-84-1.
What is the molecular formula of Dim-valeronitrile?
The molecular formula of Dim-valeronitrile is C29H36F3N5O3.
What is the molecular weight of Dim-valeronitrile?
The molecular weight of Dim-valeronitrile is 559.27704 g/mol.
Where can I buy Dim-valeronitrile?
You can request a quote for Dim-valeronitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dim-valeronitrile?
Yes, CoreyChem provides custom synthesis services for Dim-valeronitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.