4-ISOTHIOCYANATO-3,5-DIMETHYL-1-(3-METHYL-BENZYL)-1H-PYRAZOLE

Modify Date: 2025-09-26 10:46:01

4-ISOTHIOCYANATO-3,5-DIMETHYL-1-(3-METHYL-BENZYL)-1H-PYRAZOLE Structure
4-ISOTHIOCYANATO-3,5-DIMETHYL-1-(3-METHYL-BENZYL)-1H-PYRAZOLE structure
Common Name 4-ISOTHIOCYANATO-3,5-DIMETHYL-1-(3-METHYL-BENZYL)-1H-PYRAZOLE
CAS Number 1004193-39-8 Molecular Weight 257.354
Density 1.1±0.1 g/cm3 Boiling Point 427.1±45.0 °C at 760 mmHg
Molecular Formula C14H15N3S Melting Point N/A
MSDS N/A Flash Point 212.1±28.7 °C

 Names

Name 4-Isothiocyanato-3,5-dimethyl-1-(3-methylbenzyl)-1H-pyrazole
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.1±0.1 g/cm3
Boiling Point 427.1±45.0 °C at 760 mmHg
Molecular Formula C14H15N3S
Molecular Weight 257.354
Flash Point 212.1±28.7 °C
Exact Mass 257.098663
LogP 4.58
Vapour Pressure 0.0±1.0 mmHg at 25°C
Index of Refraction 1.610
InChIKey PDVYWDHNUCOWLW-UHFFFAOYSA-N
SMILES Cc1cccc(Cn2nc(C)c(N=C=S)c2C)c1

 Synonyms

4-Isothiocyanato-3,5-dimethyl-1-(3-methylbenzyl)-1H-pyrazole
1H-Pyrazole, 4-isothiocyanato-3,5-dimethyl-1-[(3-methylphenyl)methyl]-
MFCD04968725
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