二叔丁基碳二亚胺
TL;DR: 二叔丁基碳二亚胺 (CAS 691-24-7) is a chemical compound with molecular formula C9H18N2 and molecular weight 154.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二叔丁基碳二亚胺
N,N'-ditert-butylmethanediimine
Also Known As: N,N'-di-tert-Butylcarbodiimide, null, Di-tert-butylcarbodiimide, N,N-DI-TERT-BUTYLCARBODIIMIDE, di-t-butylcarbodiimide
| Molecular Formula | C9H18N2 |
|---|---|
| Molecular Weight | 154.15 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 24.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 154.147 |
| Heavy Atoms | 11 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 691-24-7 |
|---|---|
| SMILES | CC(C)(C)N=C=NC(C)(C)C |
| InChIKey | IDVWLLCLTVBSCS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二叔丁基碳二亚胺 (CAS 691-24-7), with molecular formula C9H18N2 and molecular weight 154.15 g/mol. IUPAC: N,N'-ditert-butylmethanediimine.
Chemical Property Profile of 二叔丁基碳二亚胺
Property Insights of 二叔丁基碳二亚胺
The XLogP value of 3.0 indicates that 二叔丁基碳二亚胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.7 Ų, 二叔丁基碳二亚胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二叔丁基碳二亚胺 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 二叔丁基碳二亚胺?
The CAS number of 二叔丁基碳二亚胺 is 691-24-7.
What is the molecular formula of 二叔丁基碳二亚胺?
The molecular formula of 二叔丁基碳二亚胺 is C9H18N2.
What is the molecular weight of 二叔丁基碳二亚胺?
The molecular weight of 二叔丁基碳二亚胺 is 154.15 g/mol.
Where can I buy 二叔丁基碳二亚胺?
You can request a quote for 二叔丁基碳二亚胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二叔丁基碳二亚胺?
Yes, KEHONG BIO provides custom synthesis services for 二叔丁基碳二亚胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.