5-甲基-3-庚胺
TL;DR: 5-甲基-3-庚胺 (CAS 67953-05-3) 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.
5-甲基-3-庚胺
5-methylheptan-3-amine
Also Known As: 5-methylheptan-3-amine, 3-Heptanamine, 5-methyl-, 1-Ethyl-3-methylpentylamine, 3-Amino-5-methylheptane, 5-Methyl-3-heptanamine
| 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 | 61.0 |
Chemical Identifiers
| CAS Number | 67953-05-3 |
|---|---|
| SMILES | CCC(C)CC(CC)N |
| InChIKey | HGEQWMSHDSUEJA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-甲基-3-庚胺 (CAS 67953-05-3), with molecular formula C8H19N and molecular weight 129.15 g/mol. IUPAC: 5-methylheptan-3-amine.
Chemical Property Profile of 5-甲基-3-庚胺
Property Insights of 5-甲基-3-庚胺
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-甲基-3-庚胺. With a topological polar surface area (TPSA) of 26.0 Ų, 5-甲基-3-庚胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-甲基-3-庚胺 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 5-甲基-3-庚胺?
The CAS number of 5-甲基-3-庚胺 is 67953-05-3.
What is the molecular formula of 5-甲基-3-庚胺?
The molecular formula of 5-甲基-3-庚胺 is C8H19N.
What is the molecular weight of 5-甲基-3-庚胺?
The molecular weight of 5-甲基-3-庚胺 is 129.15 g/mol.
Where can I buy 5-甲基-3-庚胺?
You can request a quote for 5-甲基-3-庚胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-甲基-3-庚胺?
Yes, KEHONG BIO provides custom synthesis services for 5-甲基-3-庚胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.