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双环[2.2.1]庚烷二甲基胺
TL;DR: 双环[2.2.1]庚烷二甲基胺 (CAS 56602-77-8) 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.
双环[2.2.1]庚烷二甲基胺
[3-(aminomethyl)-2-bicyclo[2.2.1]heptanyl]methanamine
Also Known As: Bis(aminomethyl)norbornane, Bis(aminomethyl)norbornane (mixture of isomers), Bicyclo(2.2.1)heptanedimethanamine, BICYCLO[2.2.1]HEPTANEDIMETHANAMINE, bicyclo[2.2.1]heptane-2,3-diyldimethanamine
| Molecular Formula | C9H18N2 |
|---|---|
| Molecular Weight | 154.15 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 154.147 |
| Heavy Atoms | 11 |
| Complexity | 130.0 |
Chemical Identifiers
| CAS Number | 56602-77-8 |
|---|---|
| SMILES | C1CC2CC1C(C2CN)CN |
| InChIKey | RPYFJVIASOJLJS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
双环[2.2.1]庚烷二甲基胺 (CAS 56602-77-8), with molecular formula C9H18N2 and molecular weight 154.15 g/mol. IUPAC: [3-(aminomethyl)-2-bicyclo[2.2.1]heptanyl]methanamine.
Chemical Property Profile of 双环[2.2.1]庚烷二甲基胺
Property Insights of 双环[2.2.1]庚烷二甲基胺
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 双环[2.2.1]庚烷二甲基胺. With a topological polar surface area (TPSA) of 52.0 Ų, 双环[2.2.1]庚烷二甲基胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 双环[2.2.1]庚烷二甲基胺 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 双环[2.2.1]庚烷二甲基胺?
The CAS number of 双环[2.2.1]庚烷二甲基胺 is 56602-77-8.
What is the molecular formula of 双环[2.2.1]庚烷二甲基胺?
The molecular formula of 双环[2.2.1]庚烷二甲基胺 is C9H18N2.
What is the molecular weight of 双环[2.2.1]庚烷二甲基胺?
The molecular weight of 双环[2.2.1]庚烷二甲基胺 is 154.15 g/mol.
Where can I buy 双环[2.2.1]庚烷二甲基胺?
You can request a quote for 双环[2.2.1]庚烷二甲基胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 双环[2.2.1]庚烷二甲基胺?
Yes, KEHONG BIO provides custom synthesis services for 双环[2.2.1]庚烷二甲基胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.