ML-9 free base structure

ML-9 free base

1-(5-chloronaphthalen-1-yl)sulfonyl-1,4-diazepane

CAS: 110448-31-2
Molecular Formula C15H17ClN2O2S
Molecular Weight 324.8 g/mol
LogP 2.6
Topological Polar Surface Area 57.8 A2
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 2
Exact Mass 324.06992
Heavy Atoms 21
Complexity 451.0

Chemical Identifiers

CAS Number 110448-31-2
SMILES C1CNCCN(C1)S(=O)(=O)C2=CC=CC3=C2C=CC=C3Cl
InChIKey OZSMSRIUUDGTEP-UHFFFAOYSA-N

📖 Product Overview

ML-9 free base (CAS: 110448-31-2) is a chemical compound with molecular formula C15H17ClN2O2S and molecular weight 324.8 g/mol. Its IUPAC systematic name is 1-(5-chloronaphthalen-1-yl)sulfonyl-1,4-diazepane. LogP 2.6 Topological Polar Surface Area 57.8 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 2 Exact Mass 324.06992 Heavy Atoms 21 Complexity 451.0 InChI Key: OZSMSRIUUDGTEP-UHFFFAOYSA-N. SMILES: C1CNCCN(C1)S(=O)(=O)C2=CC=CC3=C2C=CC=C3Cl.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
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Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
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