Octanenitrile, 2-amino-
TL;DR: Octanenitrile, 2-amino- (CAS 63468-70-2) is a chemical compound with molecular formula C8H16N2 and molecular weight 140.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-aminooctanenitrile
Also Known As: 2-Aminooctanenitrile, Octanenitrile, 2-amino-, 2-Amino-octansaeure-nitril, 264-253-0, EINECS 264-253-0
| Molecular Formula | C8H16N2 |
|---|---|
| Molecular Weight | 140.13 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 140.13135 |
| Heavy Atoms | 10 |
| Complexity | 112.0 |
Chemical Identifiers
| CAS Number | 63468-70-2 |
|---|---|
| SMILES | CCCCCCC(C#N)N |
| InChIKey | CJURZHVBRCKLPN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Octanenitrile, 2-amino- (CAS 63468-70-2), with molecular formula C8H16N2 and molecular weight 140.13 g/mol. IUPAC: 2-aminooctanenitrile.
Chemical Property Profile of Octanenitrile, 2-amino-
Property Insights of Octanenitrile, 2-amino-
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Octanenitrile, 2-amino-. With a topological polar surface area (TPSA) of 49.8 Ų, Octanenitrile, 2-amino- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octanenitrile, 2-amino- has 1 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 Octanenitrile, 2-amino-?
The CAS number of Octanenitrile, 2-amino- is 63468-70-2.
What is the molecular formula of Octanenitrile, 2-amino-?
The molecular formula of Octanenitrile, 2-amino- is C8H16N2.
What is the molecular weight of Octanenitrile, 2-amino-?
The molecular weight of Octanenitrile, 2-amino- is 140.13 g/mol.
Where can I buy Octanenitrile, 2-amino-?
You can request a quote for Octanenitrile, 2-amino- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octanenitrile, 2-amino-?
Yes, KEHONG BIO provides custom synthesis services for Octanenitrile, 2-amino- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.