2,2-Diphenylethylisocyanide
TL;DR: 2,2-Diphenylethylisocyanide (CAS 55577-25-8) is a chemical compound with molecular formula C15H13N and molecular weight 207.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-isocyano-1-phenylethyl)benzene
Also Known As: 2,2-Diphenylethylisocyanide, 2-(p-Tolyl)indole, (2-isocyano-1-phenylethyl)benzene, 1,1-Ethanediol,2,2-diphenyl, (2-isocyano-1-phenyl-ethyl)benzene
| Molecular Formula | C15H13N |
|---|---|
| Molecular Weight | 207.10 g/mol |
| LogP | 3.73779 |
| Topological Polar Surface Area | 4.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 207.1048 |
| Heavy Atoms | 16 |
| Complexity | 428.29306 |
Chemical Identifiers
| CAS Number | 55577-25-8 |
|---|---|
| SMILES | [C-]#[N+]CC(C1=CC=CC=C1)C2=CC=CC=C2 |
Product Overview
2,2-Diphenylethylisocyanide (CAS 55577-25-8), with molecular formula C15H13N and molecular weight 207.10 g/mol. IUPAC: (2-isocyano-1-phenylethyl)benzene.
Chemical Property Profile of 2,2-Diphenylethylisocyanide
Property Insights of 2,2-Diphenylethylisocyanide
The XLogP value of 3.73779 indicates that 2,2-Diphenylethylisocyanide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 4.36 Ų, 2,2-Diphenylethylisocyanide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Diphenylethylisocyanide has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,2-Diphenylethylisocyanide?
The CAS number of 2,2-Diphenylethylisocyanide is 55577-25-8.
What is the molecular formula of 2,2-Diphenylethylisocyanide?
The molecular formula of 2,2-Diphenylethylisocyanide is C15H13N.
What is the molecular weight of 2,2-Diphenylethylisocyanide?
The molecular weight of 2,2-Diphenylethylisocyanide is 207.10 g/mol.
Where can I buy 2,2-Diphenylethylisocyanide?
You can request a quote for 2,2-Diphenylethylisocyanide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Diphenylethylisocyanide?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Diphenylethylisocyanide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.