phenyl-(3,5,5-trimethyl-4H-pyrazol-1-yl)methanone

Modify Date: 2025-09-17 17:04:20

phenyl-(3,5,5-trimethyl-4H-pyrazol-1-yl)methanone Structure
phenyl-(3,5,5-trimethyl-4H-pyrazol-1-yl)methanone structure
Common Name phenyl-(3,5,5-trimethyl-4H-pyrazol-1-yl)methanone
CAS Number 4590-79-8 Molecular Weight 216.27900
Density 1.07g/cm3 Boiling Point 311.1ºC at 760 mmHg
Molecular Formula C13H16N2O Melting Point N/A
MSDS N/A Flash Point 142ºC

 Names

Name phenyl-(3,5,5-trimethyl-4H-pyrazol-1-yl)methanone
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.07g/cm3
Boiling Point 311.1ºC at 760 mmHg
Molecular Formula C13H16N2O
Molecular Weight 216.27900
Flash Point 142ºC
Exact Mass 216.12600
PSA 32.67000
LogP 2.06050
Index of Refraction 1.564
InChIKey VNANOPQDFPYYLB-UHFFFAOYSA-N
SMILES CC1=NN(C(=O)c2ccccc2)C(C)(C)C1

 Safety Information

HS Code 2933199090

 Synthetic Route

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phenyl-(3,5,5-trimethyl-4H-pyrazol-1-yl)methanone Structure

phenyl-(3,5,5-t...

CAS#:4590-79-8

Literature: Erschow et al. Doklady Akademii Nauk SSSR, 1957 , vol. 113, p. 813,814 Doklady Chemistry, 112-117 <1957> 313, 314 Full Text Show Details Kost et al. Vestnik Moskovskogo Universiteta, 1959 , vol. 14, p. 211,214 Chem.Abstr., 1959 , p. 21895

~%

phenyl-(3,5,5-trimethyl-4H-pyrazol-1-yl)methanone Structure

phenyl-(3,5,5-t...

CAS#:4590-79-8

Literature: Erschow et al. Doklady Akademii Nauk SSSR, 1957 , vol. 113, p. 813,815 Doklady Chemistry, 112-117 <1957> 313, 315

~%

phenyl-(3,5,5-trimethyl-4H-pyrazol-1-yl)methanone Structure

phenyl-(3,5,5-t...

CAS#:4590-79-8

Literature: Erschow et al. Doklady Akademii Nauk SSSR, 1957 , vol. 113, p. 813,815 Doklady Chemistry, 112-117 <1957> 313, 315 Full Text Show Details Kost et al. Zhurnal Obshchei Khimii, 1958 , vol. 28, p. 512,514; engl. Ausg. S. 503, 505

 Customs

HS Code 2933199090
Summary 2933199090. other compounds containing an unfused pyrazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

1-benzoyl-3,5,5-trimethyl-4,5-dihydro-1H-pyrazole
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