3-Amino-2-methylheptane
TL;DR: 3-Amino-2-methylheptane (CAS 116557-25-6) is a chemical compound with molecular formula C8H19N and molecular weight 129.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylheptan-3-amine
Also Known As: 3-Amino-2-methylheptane, 2-Methylhept-3-ylamine, 2-methylheptan-3-amine, RefChem:276373
| Molecular Formula | C8H19N |
|---|---|
| Molecular Weight | 129.15 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 129.15175 |
| Heavy Atoms | 9 |
| Complexity | 59.0 |
Chemical Identifiers
| CAS Number | 116557-25-6 |
|---|---|
| SMILES | CCCCC(C(C)C)N |
| InChIKey | WXTMKAIMGVITMT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Amino-2-methylheptane (CAS 116557-25-6), with molecular formula C8H19N and molecular weight 129.15 g/mol. IUPAC: 2-methylheptan-3-amine.
Chemical Property Profile of 3-Amino-2-methylheptane
Property Insights of 3-Amino-2-methylheptane
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-2-methylheptane. With a topological polar surface area (TPSA) of 26.0 Ų, 3-Amino-2-methylheptane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Amino-2-methylheptane 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 3-Amino-2-methylheptane?
The CAS number of 3-Amino-2-methylheptane is 116557-25-6.
What is the molecular formula of 3-Amino-2-methylheptane?
The molecular formula of 3-Amino-2-methylheptane is C8H19N.
What is the molecular weight of 3-Amino-2-methylheptane?
The molecular weight of 3-Amino-2-methylheptane is 129.15 g/mol.
Where can I buy 3-Amino-2-methylheptane?
You can request a quote for 3-Amino-2-methylheptane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-2-methylheptane?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-2-methylheptane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.