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N-Methyl-2-[(4-methylphenyl)thio]ethanamine structure
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N-Methyl-2-[(4-methylphenyl)thio]ethanamine

TL;DR: N-Methyl-2-[(4-methylphenyl)thio]ethanamine (CAS 115335-16-5) is a chemical compound with molecular formula C10H15NS and molecular weight 181.09251 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-methyl-2-(4-methylphenyl)sulfanylethanamine

Also Known As: N-METHYL-2-[(4-METHYLPHENYL)THIO]ETHANAMINE, CHEMBRDG-BB 9071937, N-Methyl-2-(p-tolylthio)ethanamine, N-methyl-2-(4-methylphenyl)sulfanylethanamine, N-methyl-2-(4-methylphenyl)sulfanyl-ethanamine

CAS Number
115335-16-5
Molecular Formula
C10H15NS
Molecular Weight
181.09251 g/mol
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Technical Specifications

Molecular FormulaC10H15NS
Molecular Weight181.09251 g/mol
XLogP2.4
Topological Polar Surface Area (TPSA)37.3 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors2
Rotatable Bonds4
Exact Mass181.09251 Da
Heavy Atoms12
Complexity108.0
SMILESCC1=CC=C(C=C1)SCCNC
InChIKeyOKXZTCFMGIUXTB-UHFFFAOYSA-N

Chemical Property Profile of N-Methyl-2-[(4-methylphenyl)thio]ethanamine

XLogP
2.4
TPSA (Topological Polar Surface Area)
37.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
Rotatable Bonds
4
Heavy Atoms
12
Complexity
108.0
Exact Mass
181.09251
Monoisotopic Mass
181.09251
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-Methyl-2-[(4-methylphenyl)thio]ethanamine

The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Methyl-2-[(4-methylphenyl)thio]ethanamine. With a topological polar surface area (TPSA) of 37.3 Ų, N-Methyl-2-[(4-methylphenyl)thio]ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Methyl-2-[(4-methylphenyl)thio]ethanamine 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

What is the CAS number of N-Methyl-2-[(4-methylphenyl)thio]ethanamine?

The CAS number of N-Methyl-2-[(4-methylphenyl)thio]ethanamine is 115335-16-5.

What is the molecular formula of N-Methyl-2-[(4-methylphenyl)thio]ethanamine?

The molecular formula of N-Methyl-2-[(4-methylphenyl)thio]ethanamine is C10H15NS.

What is the molecular weight of N-Methyl-2-[(4-methylphenyl)thio]ethanamine?

The molecular weight of N-Methyl-2-[(4-methylphenyl)thio]ethanamine is 181.09251 g/mol.

Where can I buy N-Methyl-2-[(4-methylphenyl)thio]ethanamine?

You can request a quote for N-Methyl-2-[(4-methylphenyl)thio]ethanamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for N-Methyl-2-[(4-methylphenyl)thio]ethanamine?

Yes, CoreyChem provides custom synthesis services for N-Methyl-2-[(4-methylphenyl)thio]ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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