(3S)-3-amino-1-chloro-5-methylhexan-2-one
TL;DR: (3S)-3-amino-1-chloro-5-methylhexan-2-one (CAS 52735-72-5) is a chemical compound with molecular formula C7H14ClNO and molecular weight 163.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-amino-1-chloro-5-methylhexan-2-one
Also Known As: Leucine cmk, L-Leu-CMK, Leu-chloromethyl ketone, Leucine chloromethyl ketone, L-L-CMK
| Molecular Formula | C7H14ClNO |
|---|---|
| Molecular Weight | 163.08 g/mol |
| LogP | 1.1677 |
| Topological Polar Surface Area | 43.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 163.07639 |
| Heavy Atoms | 10 |
| Complexity | 114.17374 |
Chemical Identifiers
| CAS Number | 52735-72-5 |
|---|---|
| SMILES | CC(C)C[C@@H](C(=O)CCl)N |
Product Overview
(3S)-3-amino-1-chloro-5-methylhexan-2-one (CAS 52735-72-5), with molecular formula C7H14ClNO and molecular weight 163.08 g/mol. IUPAC: (3S)-3-amino-1-chloro-5-methylhexan-2-one.
Chemical Property Profile of (3S)-3-amino-1-chloro-5-methylhexan-2-one
Property Insights of (3S)-3-amino-1-chloro-5-methylhexan-2-one
The XLogP value of 1.1677 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3S)-3-amino-1-chloro-5-methylhexan-2-one. With a topological polar surface area (TPSA) of 43.09 Ų, (3S)-3-amino-1-chloro-5-methylhexan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3S)-3-amino-1-chloro-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-1-chloro-5-methylhexan-2-one?
The CAS number of (3S)-3-amino-1-chloro-5-methylhexan-2-one is 52735-72-5.
What is the molecular formula of (3S)-3-amino-1-chloro-5-methylhexan-2-one?
The molecular formula of (3S)-3-amino-1-chloro-5-methylhexan-2-one is C7H14ClNO.
What is the molecular weight of (3S)-3-amino-1-chloro-5-methylhexan-2-one?
The molecular weight of (3S)-3-amino-1-chloro-5-methylhexan-2-one is 163.08 g/mol.
Where can I buy (3S)-3-amino-1-chloro-5-methylhexan-2-one?
You can request a quote for (3S)-3-amino-1-chloro-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-1-chloro-5-methylhexan-2-one?
Yes, KEHONG BIO provides custom synthesis services for (3S)-3-amino-1-chloro-5-methylhexan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.