4,4'-Diaminodicyclohexylmethane
TL;DR: 4,4'-Diaminodicyclohexylmethane (CAS 1761-71-3) is a chemical compound with molecular formula C13H26N2 and molecular weight 210.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-aminocyclohexyl)methyl]cyclohexan-1-amine
Also Known As: 4,4'-Methylenedicyclohexanamine, Wandamin HM, 4,4'-Diaminodicyclohexylmethane, Bis(4-aminocyclohexyl)methane, 4,4'-Methylenebis(cyclohexylamine)
| Molecular Formula | C13H26N2 |
|---|---|
| Molecular Weight | 210.21 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 210.2096 |
| Heavy Atoms | 15 |
| Complexity | 157.0 |
| Melting Point | 140-97.6 °C (cis-cis) 147.2-100.6 °C (trans-trans) |
| Boiling Point | 626 to 331.1 °C at 3 mmHg |
| Density | 0.9608 at 25.0 °C - Less dense than water; will float |
| Solubility | Insoluble (<1 mg/ml) (NTP, 1992) |
| Flash Point | greater than 93.3 °C |
Chemical Identifiers
| CAS Number | 1761-71-3 |
|---|---|
| SMILES | C1CC(CCC1CC2CCC(CC2)N)N |
| InChIKey | DZIHTWJGPDVSGE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,4'-Diaminodicyclohexylmethane (CAS 1761-71-3), with molecular formula C13H26N2 and molecular weight 210.21 g/mol. IUPAC: 4-[(4-aminocyclohexyl)methyl]cyclohexan-1-amine.
Chemical Property Profile of 4,4'-Diaminodicyclohexylmethane
Property Insights of 4,4'-Diaminodicyclohexylmethane
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4'-Diaminodicyclohexylmethane. With a topological polar surface area (TPSA) of 52.0 Ų, 4,4'-Diaminodicyclohexylmethane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4'-Diaminodicyclohexylmethane has 2 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 4,4'-Diaminodicyclohexylmethane?
The CAS number of 4,4'-Diaminodicyclohexylmethane is 1761-71-3.
What is the molecular formula of 4,4'-Diaminodicyclohexylmethane?
The molecular formula of 4,4'-Diaminodicyclohexylmethane is C13H26N2.
What is the molecular weight of 4,4'-Diaminodicyclohexylmethane?
The molecular weight of 4,4'-Diaminodicyclohexylmethane is 210.21 g/mol.
Where can I buy 4,4'-Diaminodicyclohexylmethane?
You can request a quote for 4,4'-Diaminodicyclohexylmethane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-Diaminodicyclohexylmethane?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-Diaminodicyclohexylmethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.