N,N'-二环己基碳二亚胺
TL;DR: N,N'-二环己基碳二亚胺 (CAS 538-75-0) is a chemical compound with molecular formula C13H22N2 and molecular weight 206.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N'-二环己基碳二亚胺
N,N'-dicyclohexylmethanediimine
Also Known As: DICYCLOHEXYLCARBODIIMIDE, N,N'-Dicyclohexylcarbodiimide, DCCD, DCCI, 1,3-Dicyclohexylcarbodiimide
| Molecular Formula | C13H22N2 |
|---|---|
| Molecular Weight | 206.18 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 24.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.1783 |
| Heavy Atoms | 15 |
| Complexity | 201.0 |
| Melting Point | 93 to 35.0 °C |
| Boiling Point | 252 to 123.9 °C at 6 mmHg |
| Solubility | Reaction (NTP, 1992) |
| Flash Point | greater than 112.8 °C |
| Vapor Pressure | VP: 0.5 mm Hg at 98-100 °C, 2 mm Hg at 138-140 °C, 11 mm Hg at 154-156 °C |
| GHS Signal | Danger |
| H-Statements | H302, H311, H317, H318 |
Chemical Identifiers
| CAS Number | 538-75-0 |
|---|---|
| SMILES | C1CCC(CC1)N=C=NC2CCCCC2 |
| InChIKey | QOSSAOTZNIDXMA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N'-二环己基碳二亚胺 (CAS 538-75-0), with molecular formula C13H22N2 and molecular weight 206.18 g/mol. IUPAC: N,N'-dicyclohexylmethanediimine.
Chemical Property Profile of N,N'-二环己基碳二亚胺
Property Insights of N,N'-二环己基碳二亚胺
The XLogP value of 4.7 indicates that N,N'-二环己基碳二亚胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.7 Ų, N,N'-二环己基碳二亚胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N'-二环己基碳二亚胺 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 N,N'-二环己基碳二亚胺?
The CAS number of N,N'-二环己基碳二亚胺 is 538-75-0.
What is the molecular formula of N,N'-二环己基碳二亚胺?
The molecular formula of N,N'-二环己基碳二亚胺 is C13H22N2.
What is the molecular weight of N,N'-二环己基碳二亚胺?
The molecular weight of N,N'-二环己基碳二亚胺 is 206.18 g/mol.
Where can I buy N,N'-二环己基碳二亚胺?
You can request a quote for N,N'-二环己基碳二亚胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-二环己基碳二亚胺?
Yes, KEHONG BIO provides custom synthesis services for N,N'-二环己基碳二亚胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.