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4-Nitro-5-methoxytryptamine structure
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4-Nitro-5-methoxytryptamine

TL;DR: 4-Nitro-5-methoxytryptamine (CAS 107806-90-6) is a chemical compound with molecular formula C11H13N3O3 and molecular weight 235.09569 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-(5-methoxy-4-nitro-1H-indol-3-yl)ethanamine

Also Known As: 4-Nitro-5-methoxytryptamine, 2-(5-methoxy-4-nitro-1H-indol-3-yl)ethanamine, 2-(5-Methoxy-4-nitro-1H-indol-3-yl)ethan-1-amine, 1H-Indole-3-ethanamine,5-methoxy-4-nitro-, hydrochloride (1:1)

CAS Number
107806-90-6
Molecular Formula
C11H13N3O3
Molecular Weight
235.09569 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (2 patents) Pharmaceutical Intermediates (1 patents)

Technical Specifications

Molecular FormulaC11H13N3O3
Molecular Weight235.09569 g/mol
XLogP1.2
Topological Polar Surface Area (TPSA)96.9 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors4
Rotatable Bonds3
Exact Mass235.09569 Da
Heavy Atoms17
Complexity282.0
SMILESCOC1=C(C2=C(C=C1)NC=C2CCN)[N+](=O)[O-]
InChIKeyXSQINWNNKSQCOH-UHFFFAOYSA-N

Chemical Property Profile of 4-Nitro-5-methoxytryptamine

XLogP
1.2
TPSA (Topological Polar Surface Area)
96.9
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
3
Heavy Atoms
17
Complexity
282.0
Exact Mass
235.09569
Monoisotopic Mass
235.09569
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 4-Nitro-5-methoxytryptamine

The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Nitro-5-methoxytryptamine. The TPSA of 96.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Nitro-5-methoxytryptamine. Following Lipinski's Rule of Five, 4-Nitro-5-methoxytryptamine has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 4-Nitro-5-methoxytryptamine?

The CAS number of 4-Nitro-5-methoxytryptamine is 107806-90-6.

What is the molecular formula of 4-Nitro-5-methoxytryptamine?

The molecular formula of 4-Nitro-5-methoxytryptamine is C11H13N3O3.

What is the molecular weight of 4-Nitro-5-methoxytryptamine?

The molecular weight of 4-Nitro-5-methoxytryptamine is 235.09569 g/mol.

Where can I buy 4-Nitro-5-methoxytryptamine?

You can request a quote for 4-Nitro-5-methoxytryptamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 4-Nitro-5-methoxytryptamine?

Yes, CoreyChem provides custom synthesis services for 4-Nitro-5-methoxytryptamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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