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n-Methyl-d-tryptophan structure
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n-Methyl-d-tryptophan

TL;DR: n-Methyl-d-tryptophan (CAS 1286275-84-0) is a chemical compound with molecular formula C12H14N2O2 and molecular weight 218.10553 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(2R)-3-(1H-indol-3-yl)-2-(methylamino)propanoic acid

Also Known As: n-methyl-d-tryptophan, Abrine, D-Abrine, methyl-d-tryptophan, (2R)-3-(1H-indol-3-yl)-2-(methylamino)propanoic acid

CAS Number
1286275-84-0
Molecular Formula
C12H14N2O2
Molecular Weight
218.10553 g/mol
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Application Areas

Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (11 patents) Analytical Reagents (270 patents) Biotechnology (18451 patents) Heterocyclic Building Blocks (2944 patents) Organic Building Blocks (20 patents)

Technical Specifications

Molecular FormulaC12H14N2O2
Molecular Weight218.10553 g/mol
XLogP-0.5
Topological Polar Surface Area (TPSA)65.1 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors3
Rotatable Bonds4
Exact Mass218.10553 Da
Heavy Atoms16
Complexity257.0
SMILESCN[C@H](CC1=CNC2=CC=CC=C21)C(=O)O
InChIKeyCZCIKBSVHDNIDH-LLVKDONJSA-N

Chemical Property Profile of n-Methyl-d-tryptophan

XLogP
-0.5
TPSA (Topological Polar Surface Area)
65.1
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
3
Rotatable Bonds
4
Heavy Atoms
16
Complexity
257.0
Exact Mass
218.10553
Monoisotopic Mass
218.10553
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-d-tryptophan

The XLogP value of -0.5 indicates that n-Methyl-d-tryptophan is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 65.1 Ų falls within the moderate polarity range, balancing permeability and solubility for n-Methyl-d-tryptophan. Following Lipinski's Rule of Five, n-Methyl-d-tryptophan has 3 hydrogen bond donor(s) and 3 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-d-tryptophan?

The CAS number of n-Methyl-d-tryptophan is 1286275-84-0.

What is the molecular formula of n-Methyl-d-tryptophan?

The molecular formula of n-Methyl-d-tryptophan is C12H14N2O2.

What is the molecular weight of n-Methyl-d-tryptophan?

The molecular weight of n-Methyl-d-tryptophan is 218.10553 g/mol.

Where can I buy n-Methyl-d-tryptophan?

You can request a quote for n-Methyl-d-tryptophan directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for n-Methyl-d-tryptophan?

Yes, CoreyChem provides custom synthesis services for n-Methyl-d-tryptophan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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