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N-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide structure
Fine Chemical

N-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide

TL;DR: N-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide (CAS 312635-63-5) is a chemical compound with molecular formula C12H11N5O4 and molecular weight 289.08112 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-(3-acetylphenyl)-2-(3-nitro-1,2,4-triazol-1-yl)acetamide

Also Known As: BAS 00535153, BIM-0000650.P001, N-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide, N-(3-acetylphenyl)-2-(3-nitro-1,2,4-triazol-1-yl)acetamide, N-(3-acetylphenyl)-2-(3-nitro(1,2,4-triazolyl))acetamide

CAS Number
312635-63-5
Molecular Formula
C12H11N5O4
Molecular Weight
289.08112 g/mol
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Technical Specifications

Molecular FormulaC12H11N5O4
Molecular Weight289.08112 g/mol
XLogP0.3
Topological Polar Surface Area (TPSA)123.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors6
Rotatable Bonds4
Exact Mass289.08112 Da
Heavy Atoms21
Complexity424.0
SMILESCC(=O)C1=CC(=CC=C1)NC(=O)CN2C=NC(=N2)[N+](=O)[O-]
InChIKeyYPMMTJVUXRNTJY-UHFFFAOYSA-N

Product Description

Applications: N-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

A fine chemical supplied by CoreyChem, N-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide (CAS 312635-63-5) has the molecular formula C12H11N5O4 and a molecular weight of 289.08 g/mol. Synonyms include CBMicro_000683 and BAS 00535153.

Custom synthesis (mg to ton scale), HPLC/NMR/MS analytical support, and complete COA/MSDS documentation are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of N-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide

XLogP
0.3
TPSA (Topological Polar Surface Area)
123.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
6
Rotatable Bonds
4
Heavy Atoms
21
Complexity
424.0
Exact Mass
289.08112
Monoisotopic Mass
289.08112
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-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide

The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide. Following Lipinski's Rule of Five, N-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide has 1 hydrogen bond donor(s) and 6 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-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide?

The CAS number of N-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide is 312635-63-5.

What is the molecular formula of N-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide?

The molecular formula of N-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide is C12H11N5O4.

What is the molecular weight of N-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide?

The molecular weight of N-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide is 289.08112 g/mol.

What are the applications of N-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide?

N-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full...

Where can I buy N-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide?

You can request a quote for N-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for N-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide?

Yes, CoreyChem provides custom synthesis services for N-(3-acetylphenyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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