N,N'-羰基二咪唑
TL;DR: N,N'-羰基二咪唑 (CAS 530-62-1) is a chemical compound with molecular formula C7H6N4O and molecular weight 162.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N'-羰基二咪唑
di(imidazol-1-yl)methanone
Also Known As: 1,1'-Carbonyldiimidazole, N,N'-Carbonyldiimidazole, di(1H-imidazol-1-yl)methanone, Carbonyldiimidazole, N,N-Carbonyldiimidazole
| Molecular Formula | C7H6N4O |
|---|---|
| Molecular Weight | 162.05 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 52.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 162.05415 |
| Heavy Atoms | 12 |
| Complexity | 166.0 |
| Melting Point | 116.0 |
| GHS Signal | Danger |
| H-Statements | H302, H314 |
Chemical Identifiers
| CAS Number | 530-62-1 |
|---|---|
| SMILES | C1=CN(C=N1)C(=O)N2C=CN=C2 |
| InChIKey | PFKFTWBEEFSNDU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N'-羰基二咪唑 (CAS 530-62-1), with molecular formula C7H6N4O and molecular weight 162.05 g/mol. IUPAC: di(imidazol-1-yl)methanone.
Chemical Property Profile of N,N'-羰基二咪唑
Property Insights of N,N'-羰基二咪唑
The XLogP value of -0.2 indicates that N,N'-羰基二咪唑 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.7 Ų, N,N'-羰基二咪唑 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N'-羰基二咪唑 has 0 hydrogen bond donor(s) and 3 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 N,N'-羰基二咪唑?
The CAS number of N,N'-羰基二咪唑 is 530-62-1.
What is the molecular formula of N,N'-羰基二咪唑?
The molecular formula of N,N'-羰基二咪唑 is C7H6N4O.
What is the molecular weight of N,N'-羰基二咪唑?
The molecular weight of N,N'-羰基二咪唑 is 162.05 g/mol.
Where can I buy N,N'-羰基二咪唑?
You can request a quote for N,N'-羰基二咪唑 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-羰基二咪唑?
Yes, KEHONG BIO provides custom synthesis services for N,N'-羰基二咪唑 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.