Isocyanocyclopropane
TL;DR: Isocyanocyclopropane (CAS 58644-53-4) is a chemical compound with molecular formula C4H5N and molecular weight 67.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
isocyanocyclopropane
Also Known As: Isocyanocyclopropane, Cyclopropyl isocyanide, cyclopropylisocyanide, cyclopropylisonitrile, Isocyano-cyclopropane
| Molecular Formula | C4H5N |
|---|---|
| Molecular Weight | 67.04 g/mol |
| LogP | 1.06809 |
| Topological Polar Surface Area | 4.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 67.0422 |
| Heavy Atoms | 5 |
| Complexity | 66.20736 |
Chemical Identifiers
| CAS Number | 58644-53-4 |
|---|---|
| SMILES | [C-]#[N+]C1CC1 |
Product Overview
Isocyanocyclopropane (CAS 58644-53-4), with molecular formula C4H5N and molecular weight 67.04 g/mol. IUPAC: isocyanocyclopropane.
Chemical Property Profile of Isocyanocyclopropane
Property Insights of Isocyanocyclopropane
The XLogP value of 1.06809 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isocyanocyclopropane. With a topological polar surface area (TPSA) of 4.36 Ų, Isocyanocyclopropane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isocyanocyclopropane 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 Isocyanocyclopropane?
The CAS number of Isocyanocyclopropane is 58644-53-4.
What is the molecular formula of Isocyanocyclopropane?
The molecular formula of Isocyanocyclopropane is C4H5N.
What is the molecular weight of Isocyanocyclopropane?
The molecular weight of Isocyanocyclopropane is 67.04 g/mol.
Where can I buy Isocyanocyclopropane?
You can request a quote for Isocyanocyclopropane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isocyanocyclopropane?
Yes, KEHONG BIO provides custom synthesis services for Isocyanocyclopropane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.