Acetamide, 2-isocyano-N,N-dimethyl-
TL;DR: Acetamide, 2-isocyano-N,N-dimethyl- (CAS 68157-98-2) is a chemical compound with molecular formula C5H8N2O and molecular weight 112.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-isocyano-N,N-dimethylacetamide
Also Known As: 2-Isocyano-N,N-dimethylacetamide, Acetamide, 2-isocyano-N,N-dimethyl-, N,N-dimethyl-alpha-isocyanoacetamide, N,N-Dimethyl-2-isocyanoacetamide, ACETAMIDE,2-ISOCYANO-N,N-DIMETHYL-
| Molecular Formula | C5H8N2O |
|---|---|
| Molecular Weight | 112.06 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 24.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 112.06366 |
| Heavy Atoms | 8 |
| Complexity | 131.0 |
Chemical Identifiers
| CAS Number | 68157-98-2 |
|---|---|
| SMILES | CN(C)C(=O)C[N+]#[C-] |
| InChIKey | YTLIISRHCPJHLB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Acetamide, 2-isocyano-N,N-dimethyl- (CAS 68157-98-2), with molecular formula C5H8N2O and molecular weight 112.06 g/mol. IUPAC: 2-isocyano-N,N-dimethylacetamide.
Chemical Property Profile of Acetamide, 2-isocyano-N,N-dimethyl-
Property Insights of Acetamide, 2-isocyano-N,N-dimethyl-
The XLogP value of -0.4 indicates that Acetamide, 2-isocyano-N,N-dimethyl- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 24.7 Ų, Acetamide, 2-isocyano-N,N-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetamide, 2-isocyano-N,N-dimethyl- has 0 hydrogen bond donor(s) and 2 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 Acetamide, 2-isocyano-N,N-dimethyl-?
The CAS number of Acetamide, 2-isocyano-N,N-dimethyl- is 68157-98-2.
What is the molecular formula of Acetamide, 2-isocyano-N,N-dimethyl-?
The molecular formula of Acetamide, 2-isocyano-N,N-dimethyl- is C5H8N2O.
What is the molecular weight of Acetamide, 2-isocyano-N,N-dimethyl-?
The molecular weight of Acetamide, 2-isocyano-N,N-dimethyl- is 112.06 g/mol.
Where can I buy Acetamide, 2-isocyano-N,N-dimethyl-?
You can request a quote for Acetamide, 2-isocyano-N,N-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetamide, 2-isocyano-N,N-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for Acetamide, 2-isocyano-N,N-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.