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[2-(3-benzyl-1H-1,2,4-triazol-5-yl)ethyl]amine hydrochloride structure
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[2-(3-benzyl-1H-1,2,4-triazol-5-yl)ethyl]amine hydrochloride

TL;DR: [2-(3-benzyl-1H-1,2,4-triazol-5-yl)ethyl]amine hydrochloride (CAS 1185023-32-8) is a chemical compound with molecular formula C11H14N4 and molecular weight 202.12184 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-(5-benzyl-1H-1,2,4-triazol-3-yl)ethanamine

Also Known As: 2-(5-benzyl-1H-1,2,4-triazol-3-yl)ethanamine, 3-(Phenylmethyl)-1H-1,2,4-triazole-5-ethanamine, [2-(3-benzyl-1H-1,2,4-triazol-5-yl)ethyl]amine hydrochloride, 2-(3-Benzyl-1H-1,2,4-triazol-5-yl)ethanamine hydrochloride, 2-(5-Benzyl-1H-1,2,4-triazol-3-yl)ethan-1-amine

CAS Number
1185023-32-8
Molecular Formula
C11H14N4
Molecular Weight
202.12184 g/mol
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Technical Specifications

Molecular FormulaC11H14N4
Molecular Weight202.12184 g/mol
XLogP1.3
Topological Polar Surface Area (TPSA)67.6 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors3
Rotatable Bonds4
Exact Mass202.12184 Da
Heavy Atoms15
Complexity179.0
SMILESC1=CC=C(C=C1)CC2=NC(=NN2)CCN
InChIKeyBMMDUPBSLLIHKR-UHFFFAOYSA-N

Chemical Property Profile of [2-(3-benzyl-1H-1,2,4-triazol-5-yl)ethyl]amine hydrochloride

XLogP
1.3
TPSA (Topological Polar Surface Area)
67.6
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
Rotatable Bonds
4
Heavy Atoms
15
Complexity
179.0
Exact Mass
202.12184
Monoisotopic Mass
202.12184
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 [2-(3-benzyl-1H-1,2,4-triazol-5-yl)ethyl]amine hydrochloride

The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(3-benzyl-1H-1,2,4-triazol-5-yl)ethyl]amine hydrochloride. The TPSA of 67.6 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(3-benzyl-1H-1,2,4-triazol-5-yl)ethyl]amine hydrochloride. Following Lipinski's Rule of Five, [2-(3-benzyl-1H-1,2,4-triazol-5-yl)ethyl]amine hydrochloride has 2 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 [2-(3-benzyl-1H-1,2,4-triazol-5-yl)ethyl]amine hydrochloride?

The CAS number of [2-(3-benzyl-1H-1,2,4-triazol-5-yl)ethyl]amine hydrochloride is 1185023-32-8.

What is the molecular formula of [2-(3-benzyl-1H-1,2,4-triazol-5-yl)ethyl]amine hydrochloride?

The molecular formula of [2-(3-benzyl-1H-1,2,4-triazol-5-yl)ethyl]amine hydrochloride is C11H14N4.

What is the molecular weight of [2-(3-benzyl-1H-1,2,4-triazol-5-yl)ethyl]amine hydrochloride?

The molecular weight of [2-(3-benzyl-1H-1,2,4-triazol-5-yl)ethyl]amine hydrochloride is 202.12184 g/mol.

Where can I buy [2-(3-benzyl-1H-1,2,4-triazol-5-yl)ethyl]amine hydrochloride?

You can request a quote for [2-(3-benzyl-1H-1,2,4-triazol-5-yl)ethyl]amine hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for [2-(3-benzyl-1H-1,2,4-triazol-5-yl)ethyl]amine hydrochloride?

Yes, CoreyChem provides custom synthesis services for [2-(3-benzyl-1H-1,2,4-triazol-5-yl)ethyl]amine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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