二环己胺
TL;DR: 二环己胺 (CAS 101-83-7) is a chemical compound with molecular formula C12H23N and molecular weight 181.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二环己胺
N-cyclohexylcyclohexanamine
Also Known As: DICYCLOHEXYLAMINE, N-Cyclohexylcyclohexanamine, DCHA, Dicha, Dicyklohexylamin
| Molecular Formula | C12H23N |
|---|---|
| Molecular Weight | 181.18 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 181.18304 |
| Heavy Atoms | 13 |
| Complexity | 116.0 |
| Melting Point | 20.0 °C |
| Boiling Point | 255.8 °C at 760 mmHg |
| Density | 0.913 to 0.919 at 15.0 °C |
| Solubility | Slightly soluble (NTP, 1992) |
| Flash Point | greater than 98.9 °C |
| Vapor Pressure | 0.03 [mmHg] |
| Refractive Index | 1.4823 @ 25 °C |
Chemical Identifiers
| CAS Number | 101-83-7 |
|---|---|
| SMILES | C1CCC(CC1)NC2CCCCC2 |
| InChIKey | XBPCUCUWBYBCDP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二环己胺 (CAS 101-83-7), with molecular formula C12H23N and molecular weight 181.18 g/mol. IUPAC: N-cyclohexylcyclohexanamine.
Chemical Property Profile of 二环己胺
Property Insights of 二环己胺
The XLogP value of 3.4 indicates that 二环己胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, 二环己胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二环己胺 has 1 hydrogen bond donor(s) and 1 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 二环己胺?
The CAS number of 二环己胺 is 101-83-7.
What is the molecular formula of 二环己胺?
The molecular formula of 二环己胺 is C12H23N.
What is the molecular weight of 二环己胺?
The molecular weight of 二环己胺 is 181.18 g/mol.
Where can I buy 二环己胺?
You can request a quote for 二环己胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二环己胺?
Yes, KEHONG BIO provides custom synthesis services for 二环己胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.