Cycloheptyl isocyanide
TL;DR: Cycloheptyl isocyanide (CAS 134420-07-8) is a chemical compound with molecular formula C8H13N and molecular weight 123.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
isocyanocycloheptane
Also Known As: cycloheptyl isocyanide, isocyanocycloheptane, Cycloheptylisocyanide, cycloheptyl isonitrile, Cycloheptane, isocyano- (9CI)
| Molecular Formula | C8H13N |
|---|---|
| Molecular Weight | 123.10 g/mol |
| LogP | 2.62849 |
| Topological Polar Surface Area | 4.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 123.1048 |
| Heavy Atoms | 9 |
| Complexity | 104.226265 |
Chemical Identifiers
| CAS Number | 134420-07-8 |
|---|---|
| SMILES | [C-]#[N+]C1CCCCCC1 |
Product Overview
Cycloheptyl isocyanide (CAS 134420-07-8), with molecular formula C8H13N and molecular weight 123.10 g/mol. IUPAC: isocyanocycloheptane.
Chemical Property Profile of Cycloheptyl isocyanide
Property Insights of Cycloheptyl isocyanide
The XLogP value of 2.62849 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cycloheptyl isocyanide. With a topological polar surface area (TPSA) of 4.36 Ų, Cycloheptyl isocyanide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cycloheptyl isocyanide 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 Cycloheptyl isocyanide?
The CAS number of Cycloheptyl isocyanide is 134420-07-8.
What is the molecular formula of Cycloheptyl isocyanide?
The molecular formula of Cycloheptyl isocyanide is C8H13N.
What is the molecular weight of Cycloheptyl isocyanide?
The molecular weight of Cycloheptyl isocyanide is 123.10 g/mol.
Where can I buy Cycloheptyl isocyanide?
You can request a quote for Cycloheptyl isocyanide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cycloheptyl isocyanide?
Yes, KEHONG BIO provides custom synthesis services for Cycloheptyl isocyanide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.