6-Phenyl-4,5-dihydro-1,2,4-triazin-3(2H)-one

Basic Information

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CAS Number

78831-00-2

Molecular Formula

C9H9N3O

Molecular Weight

175.19 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

SMILES

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C1C(=NNC(=O)N1)C2=CC=CC=C2

InChI

InChI=1S/C9H9N3O/c13-9-10-6-8(11-12-9)7-4-2-1-3-5-7/h1-5H,6H2,(H2,10,12,13)

InChIKey

LWMREWHCHKZSDF-UHFFFAOYSA-N

LogP

0.7035

Topological Polar Surface Area

53.49 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

231

Synonyms & References

English

SB73393
AKOS027255651
MFCD01088874
W10750
6-Phenyl-4,5-dihydro-1,2,4-triazin-3(2H)-one
78831-00-2
6-Phenyl-2,3,4,5-tetrahydro-1,2,4-triazin-3-one
SY126795
hydroxy-6-phenyl-4,5-dihydro-1,2,4-triazine
6-phenyl-4,5-dihydro-2H-1,2,4-triazin-3-one
AS-67011
1,2,4-Triazin-3(2H)-one, 4,5-dihydro-6-phenyl-
CS-0037449
DTXSID70354623
SCHEMBL7317752
6-Phenyl-2,3,4,5-Tetrahydro-1,2,4-Triazin-3-One

MDL Number

MFCD01088874

FAQ

What regulatory guidelines apply to 6-Phenyl-4,5-dihydro-1,2,4-triazin-3(2H)-one (CAS: 78831-00-2)?

6-Phenyl-4,5-dihydro-1,2,4-triazin-3(2H)-one (CAS: 78831-00-2) falls under the scope of the REACH regulation in Europe, which requires registration and reporting of substances. In the United States, it must comply with EPA regulations related to the manufacture, processing, and distribution of hazardous substances. Additionally, the compound should be assessed for its GHS classification to ensure proper labeling and handling according to the Globally Harmonized System of Classification and Labelling of Chemicals.

Are there alternatives to 6-Phenyl-4,5-dihydro-1,2,4-triazin-3(2H)-one in synthesis?

While 6-Phenyl-4,5-dihydro-1,2,4-triazin-3(2H)-one (CAS: 78831-00-2) is a versatile compound, its synthesis can sometimes be achieved with minor modifications using alternative reagents such as 1,2,4-triazole derivatives. Analogous compounds like 5-phenyl-1,2,4-triazoles can serve as effective synthetic alternatives, offering similar functionalities with slight structural differences.

What is the market or research trend for 6-Phenyl-4,5-dihydro-1,2,4-triazin-3(2H)-one (CAS: 78831-00-2)?

The market for 6-Phenyl-4,5-dihydro-1,2,4-triazin-3(2H)-one (CAS: 78831-00-2) is growing due to its applications in pharmaceuticals and agrochemicals. Research trends focus on its use as a precursor in the synthesis of bioactive compounds and as a herbicide. Recent studies are also exploring its potential in anti-inflammatory and antiviral drug development, driven by its triazine ring structure and reactivity.

How should waste containing 6-Phenyl-4,5-dihydro-1,2,4-triazin-3(2H)-one (CAS: 78831-00-2) be handled?

Waste containing 6-Phenyl-4,5-dihydro-1,2,4-triazin-3(2H)-one (CAS: 78831-00-2) should be collected and stored in sealed containers to prevent environmental contamination. For incineration, it should be burned in a controlled incinerator to ensure complete destruction. Alternatively, professional waste disposal services can handle the waste through chemical neutralization or other safe disposal methods. Proper environmental protection measures, including the use of appropriate personal protective equipment, should be followed to minimize health and environmental risks.

Related Compounds

N-[(3S)-1-(Dimethylcarbamoyl)-3-pyrrolidinyl]-5-[(Z)-(5-fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide

CAS Number: 1013920-15-4

Molecular Formula: C23H26FN5O3

7-Methylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid structure

Compound Q&A

What is 6-Methyl-7-oxabicyclo[4.1.0]heptan-2-one (CAS: 21889-89-4)?

6-Methyl-7-oxabicyclo[4.1.0]heptan-2-one is a cyclic ketone with a molecular for...

21889-89-46-Methyl-7-oxabicycl...

Compound Q&A

What is 4-[(6-Methyl-2-pyrazinyl)oxy]benzoic acid (CAS: 906353-00-2)?

4-[(6-Methyl-2-pyrazinyl)oxy]benzoic acid is a chemical compound with the CAS nu...

906353-00-24-[(6-Methyl-2-pyraz...

Compound Q&A

What is 2-(2-Pyridinyl)-1,3-propanediol (CAS: 49745-42-8)?

2-(2-Pyridinyl)-1,3-propanediol (CAS: 49745-42-8) is a colorless to slightly yel...

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Compound Q&A

What is 2-(6-Chloro-2-pyridinyl)-2-phenylacetonitrile (CAS: 24783-42-4)?

2-(6-Chloro-2-pyridinyl)-2-phenylacetonitrile is an organic compound with the CA...

24783-42-42-(6-Chloro-2-pyridi...

Compound Q&A

What is 2-Oxopropanamide (CAS: 631-66-3)?

2-Oxopropanamide, also known as 2-aminoacrylic acid, is a chemical compound with...

631-66-32-Oxopropanamide

Compound Q&A

What is 2-Methyl-2-propanyl 4-(5-bromo-6-methyl-2-pyridinyl)-1-piperazinecarboxylate (CAS: 1289040-88-5)?

2-Methyl-2-propanyl 4-(5-bromo-6-methyl-2-pyridinyl)-1-piperazinecarboxylate (CA...

1289040-88-52-Methyl-2-propanyl ...

Compound Q&A

What is NAMPT inhibitor-linker 1 (CAS: 2241019-57-6)?

NAMPT inhibitor-linker 1 (CAS: 2241019-57-6) is a chemical compound designed as ...

2241019-57-6NAMPT inhibitor-link...

Compound Q&A

What is (2-(2,2,2-Trifluoroacetyl)pyridin-4-yl)boronic acid (CAS: 1310404-58-0)?

It is a chemical compound with the structure (2-(2,2,2-Trifluoroacetyl)pyridin-4...

1310404-58-0(2-(2,2,2-Trifluoroa...

Compound Q&A

What is 1-(2-Chlorophenyl)-6-(3,3,3-trifluoro-2-methylpropyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one (CAS: 794568-90-4)?

1-(2-Chlorophenyl)-6-(3,3,3-trifluoro-2-methylpropyl)-1,5-dihydro-4H-pyrazolo[3,...

794568-90-41-(2-Chlorophenyl)-6...

Compound Q&A

What is Vinyl(chloromethyl)dimethoxysilane (CAS: 1314981-48-0)?

Vinyl(chloromethyl)dimethoxysilane is an organosilicon compound with the molecul...

1314981-48-0Vinyl(chloromethyl)d...

6-Phenyl-4,5-dihydro-1,2,4-triazin-3(2H)-one | CAS No. 78831-00-2

Basic Information

CAS Number

Molecular Formula

Molecular Weight

Chemical Classification

Basic Physical Properties

Chemical Properties

SMILES

InChI

InChIKey

LogP

Topological Polar Surface Area

Hydrogen Bond Donor/Acceptor

Complexity

Synonyms & References

English

MDL Number

FAQ

What regulatory guidelines apply to 6-Phenyl-4,5-dihydro-1,2,4-triazin-3(2H)-one (CAS: 78831-00-2)?

Are there alternatives to 6-Phenyl-4,5-dihydro-1,2,4-triazin-3(2H)-one in synthesis?

What is the market or research trend for 6-Phenyl-4,5-dihydro-1,2,4-triazin-3(2H)-one (CAS: 78831-00-2)?

How should waste containing 6-Phenyl-4,5-dihydro-1,2,4-triazin-3(2H)-one (CAS: 78831-00-2) be handled?

Related Compounds

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What is 2-(2-Pyridinyl)-1,3-propanediol (CAS: 49745-42-8)?

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What is Vinyl(chloromethyl)dimethoxysilane (CAS: 1314981-48-0)?

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