(3S)-3-amino-5-methylhexan-2-one
TL;DR: (3S)-3-amino-5-methylhexan-2-one (CAS 114416-27-2) is a chemical compound with molecular formula C7H15NO and molecular weight 129.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-amino-5-methylhexan-2-one
Also Known As: (3S)-3-amino-5-methylhexan-2-one, Leu-CH..3.., 3-Amino-5-methyl-hexan-2-one, (S)-3-Amino-5-methylhexan-2-one, 2-Hexanone, 3-amino-5-methyl-, (S)- (9CI)
| Molecular Formula | C7H15NO |
|---|---|
| Molecular Weight | 129.12 g/mol |
| LogP | 0.9488 |
| Topological Polar Surface Area | 43.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 129.11537 |
| Heavy Atoms | 9 |
| Complexity | 99.08927 |
Chemical Identifiers
| CAS Number | 114416-27-2 |
|---|---|
| SMILES | CC(C)C[C@@H](C(=O)C)N |
Product Overview
(3S)-3-amino-5-methylhexan-2-one (CAS 114416-27-2), with molecular formula C7H15NO and molecular weight 129.12 g/mol. IUPAC: (3S)-3-amino-5-methylhexan-2-one.
Chemical Property Profile of (3S)-3-amino-5-methylhexan-2-one
Property Insights of (3S)-3-amino-5-methylhexan-2-one
The XLogP value of 0.9488 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3S)-3-amino-5-methylhexan-2-one. With a topological polar surface area (TPSA) of 43.09 Ų, (3S)-3-amino-5-methylhexan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3S)-3-amino-5-methylhexan-2-one 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 (3S)-3-amino-5-methylhexan-2-one?
The CAS number of (3S)-3-amino-5-methylhexan-2-one is 114416-27-2.
What is the molecular formula of (3S)-3-amino-5-methylhexan-2-one?
The molecular formula of (3S)-3-amino-5-methylhexan-2-one is C7H15NO.
What is the molecular weight of (3S)-3-amino-5-methylhexan-2-one?
The molecular weight of (3S)-3-amino-5-methylhexan-2-one is 129.12 g/mol.
Where can I buy (3S)-3-amino-5-methylhexan-2-one?
You can request a quote for (3S)-3-amino-5-methylhexan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3S)-3-amino-5-methylhexan-2-one?
Yes, KEHONG BIO provides custom synthesis services for (3S)-3-amino-5-methylhexan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.