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3-Methyl-1-phenylpyrazolone

3-Methyl-1-phenylpyrazolone structure

CAS No:
19735-89-8
Formula:
C10H10N2O
Chemical Name:
3-Methyl-1-phenylpyrazolone
Synonyms:
3H-Pyrazol-3-one,1,2-dihydro-5-methyl-2-phenyl-;3-Pyrazolin-5-one,3-methyl-1-phenyl-;1,2-Dihydro-5-methyl-2-phenyl-3H-pyrazol-3-one;3-Methyl-1-phenylpyrazolone;N-Desmethylantipyrine;N-Demethylantipyrine;1-Phenyl-3-methyl-Δ3-pyrazol-5-one;1-Phenyl-3-methyl-5-pyrazolone;5-Methyl-2-phenyl-1,2-dihydropyrazol-3-one;2,3-Dihydro-5-methyl-2-phenyl-1H-pyrazol-3-one
Categories:
Chemical Reagents > Organic Reagents

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Description

Solid

3-Methyl-1-phenylpyrazolone Basic Attributes

Molecular Weight：

174.19900

Exact Mass：

174.20

EC Number：

213-390-4|243-261-8

UNII：

S798V6YJRP

DSSTox ID：

DTXSID9061334|DTXSID6091550

HScode：

2933199090

Characteristics

PSA：

37.79000

XLogP3：

1.47400

Density：

1.178g/cm3

Melting Point：

128 °C

Boiling Point：

276.4ºC

Flash Point：

121ºC

Refractive Index：

1.586

Water Solubility：

380.9 mg/L @ 25 °C (est)

Vapor Pressure：

0.0048mmHg at 25°C

Drug Information

Metabolism/Metabolites：

Edaravone has known human metabolites that include (2S,3S,4S,5R)-3,4,5-trihydroxy-6-(5-methyl-2-phenylpyrazol-3-yl)oxyoxane-2-carboxylic acid.

MeSH Entry Terms：

N-demethylantipyrine

3-Methyl-1-phenylpyrazolone Use and Manufacturing

Manufacturing Info：

1H-Pyrazol-5-ol, 3-methyl-1-phenyl-: INACTIVE

Computed Properties

Molecular Weight:174.20
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:174.079312947
Monoisotopic Mass:174.079312947
Topological Polar Surface Area:32.3
Heavy Atom Count:13
Complexity:241
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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1,2-Dihydro-5-methyl-2-phenyl-3H-pyrazol-3-one CAS19735-89-8

CAS No.: 19735-89-8

Grade: Industrial Grade

Content: 99%

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Guide of 3-Methyl-1-phenylpyrazolone

Description
Basic Attributes
Characteristics
Drug Information
Use and Manufacturing
Computed Properties
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