3-甲基-1-己胺
TL;DR: 3-甲基-1-己胺 (CAS 65530-93-0) is a chemical compound with molecular formula C7H17N and molecular weight 115.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-甲基-1-己胺
3-methylhexan-1-amine
Also Known As: 3-methylhexan-1-amine, 3-Methylhexylamine, 1-Hexanamine, 3-methyl-, 3-Methyl-1-hexanamine, 1-Amino-3-methyl-hexan
| Molecular Formula | C7H17N |
|---|---|
| Molecular Weight | 115.14 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 115.1361 |
| Heavy Atoms | 8 |
| Complexity | 43.0 |
Chemical Identifiers
| CAS Number | 65530-93-0 |
|---|---|
| SMILES | CCCC(C)CCN |
| InChIKey | AWBMXILPKKHYSO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-甲基-1-己胺 (CAS 65530-93-0), with molecular formula C7H17N and molecular weight 115.14 g/mol. IUPAC: 3-methylhexan-1-amine.
Chemical Property Profile of 3-甲基-1-己胺
Property Insights of 3-甲基-1-己胺
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-甲基-1-己胺. With a topological polar surface area (TPSA) of 26.0 Ų, 3-甲基-1-己胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-甲基-1-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 3-甲基-1-己胺?
The CAS number of 3-甲基-1-己胺 is 65530-93-0.
What is the molecular formula of 3-甲基-1-己胺?
The molecular formula of 3-甲基-1-己胺 is C7H17N.
What is the molecular weight of 3-甲基-1-己胺?
The molecular weight of 3-甲基-1-己胺 is 115.14 g/mol.
Where can I buy 3-甲基-1-己胺?
You can request a quote for 3-甲基-1-己胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-甲基-1-己胺?
Yes, KEHONG BIO provides custom synthesis services for 3-甲基-1-己胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.