N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine structure

N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine

TL;DR: N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine (CAS 31687-95-3) is a chemical compound with molecular formula C26H36N2O3S2 and molecular weight 488.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

cyclohexylsulfamic acid;N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine

Also Known As: N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine, cyclohexylsulfamic acid;N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine, Cyclohexylsulfamic acid--N,N-dimethyl-1-[2-(9-methyl-9H-thioxanthen-9-yl)cyclopropyl]methanamine (1/1), cyclohexylsulfamic acid; N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine

CAS: 31687-95-3
Molecular Formula C26H36N2O3S2
Molecular Weight 488.22 g/mol
LogP 5.3664
Topological Polar Surface Area 103.0 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 5
Exact Mass 488.21674
Heavy Atoms 33
Complexity 585.0

Chemical Identifiers

CAS Number 31687-95-3
SMILES CC1(C2=CC=CC=C2SC3=CC=CC=C31)C4CC4CN(C)C.C1CCC(CC1)NS(=O)(=O)O
InChIKey YFCLEUNUPGAVBB-UHFFFAOYSA-N

Product Overview

N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine (CAS 31687-95-3), with molecular formula C26H36N2O3S2 and molecular weight 488.22 g/mol. IUPAC: cyclohexylsulfamic acid;N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine.

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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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Chemical Property Profile of N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine

XLogP
5.3664
TPSA (Topological Polar Surface Area)
103.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
6
Rotatable Bonds
5
Heavy Atoms
33
Complexity
585.0
Exact Mass
488.21674
Monoisotopic Mass
488.21674
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine

The XLogP value of 5.3664 indicates that N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine. Following Lipinski's Rule of Five, N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the typical lead time for this product?
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.
Can you provide samples for testing?
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.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine?

The CAS number of N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine is 31687-95-3.

What is the molecular formula of N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine?

The molecular formula of N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine is C26H36N2O3S2.

What is the molecular weight of N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine?

The molecular weight of N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine is 488.22 g/mol.

Where can I buy N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine?

You can request a quote for N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine?

Yes, KEHONG BIO provides custom synthesis services for N,N-dimethyl-1-[2-(9-methylthioxanthen-9-yl)cyclopropyl]methanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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