3,5-Dimethyl-4-P-tolylsulfanyl-1H-pyrazole

IUPAC: 3,5-dimethyl-4-(4-methylphenyl)sulfanyl-1H-pyrazole

CAS 385405-23-2

C₁₂H₁₄N₂S

3,5-Dimethyl-4-P-tolylsulfanyl-1H-pyrazole (CAS 385405-23-2) is a chemical compound with molecular formula C₁₂H₁₄N₂S and molecular weight 218.32 g/mol . GHS signal word: Warning. Hazard classifications: Health Hazard.

What is 3,5-Dimethyl-4-P-tolylsulfanyl-1H-pyrazole?

Molecular Formula: C12H14N2S
Molecular Weight: 218.32 g/mol

Structure Identifiers

SMILES: CC1=CC=C(C=C1)SC2=C(NN=C2C)C
InChI: InChI=1S/C12H14N2S/c1-8-4-6-11(7-5-8)15-12-9(2)13-14-10(12)3/h4-7H,1-3H3,(H,13,14)
InChIKey: RVMKFXZYJZRTGS-UHFFFAOYSA-N

Properties

Computed

Calculated molecular descriptors used in drug design and computational chemistry.

Exact Mass: 218.0878 Da
XLogP: 3.40
TPSA: 54.0 Ų
H-Bond Donors: 1
H-Bond Acceptors: 2
Complexity: 202
Formal Charge: 0

Safety information

Signal Word

Warning

GHS Pictograms

GHS07

Hazard Statements

H302 Harmful if swallowed

Precautionary Statements

P261 Avoid breathing dust/fume/gas/mist/vapours/spray
P264 Wash thoroughly after handling
P270 Do not eat, drink or smoke when using this product
P271 Use only outdoors or in a well-ventilated area
P280 Wear protective gloves/protective clothing/eye protection/face protection
P302+P352 IF ON SKIN: Wash with soap and water
P304+P340 IF INHALED: Remove victim to fresh air and keep at rest in a position comfortable for breathing
P305+P351+P338 IF IN EYES: Rinse continuously with water for several minutes. Remove contact lenses if present and easy to do, continue rinsing
P321 Specific treatment (see supplemental first aid instructions on this label)
P330 Rinse mouth
P403+P233 Store in a well-ventilated place. Keep container tightly closed
P405 Store locked up
P501 Dispose of contents/container to an approved waste disposal plant

Synonyms (16)

CS-0281432
F0755-0030
HMS1584K17
385405-23-2
EN300-236089
AKOS002663377
SR-01000443883
AF-399/15186003
SR-01000443883-1
Cambridge id 5774713
3,5-dimethyl-4-(p-tolylthio)-1H-pyrazole
3,5-DIMETHYL-4-P-TOLYLSULFANYL-1H-PYRAZOLE
3,5-Dimethyl-4-[(4-methylphenyl)thio]-1H-pyrazole
3,5-dimethyl-1H-pyrazol-4-yl 4-methylphenyl sulfide
3,5-dimethyl-4-(4-methylphenyl)sulfanyl-1H-pyrazole
3,5-dimethyl-4-[(4-methylphenyl)sulfanyl]-1H-pyrazole

Frequently asked questions

What is the CAS number of 3,5-Dimethyl-4-P-tolylsulfanyl-1H-pyrazole?

The CAS Registry Number for 3,5-Dimethyl-4-P-tolylsulfanyl-1H-pyrazole is 385405-23-2.

What is the IUPAC name of 3,5-Dimethyl-4-P-tolylsulfanyl-1H-pyrazole?

The IUPAC name of 3,5-Dimethyl-4-P-tolylsulfanyl-1H-pyrazole is 3,5-dimethyl-4-(4-methylphenyl)sulfanyl-1H-pyrazole.

What is the molecular formula of 3,5-Dimethyl-4-P-tolylsulfanyl-1H-pyrazole?

3,5-Dimethyl-4-P-tolylsulfanyl-1H-pyrazole has the molecular formula C12H14N2S and a molecular weight of 218.32 g/mol.

What is the SMILES notation for 3,5-Dimethyl-4-P-tolylsulfanyl-1H-pyrazole?

The SMILES notation for 3,5-Dimethyl-4-P-tolylsulfanyl-1H-pyrazole is CC1=CC=C(C=C1)SC2=C(NN=C2C)C.

Is 3,5-Dimethyl-4-P-tolylsulfanyl-1H-pyrazole hazardous?

3,5-Dimethyl-4-P-tolylsulfanyl-1H-pyrazole carries the following GHS hazard classifications: Health Hazard. Signal word: Warning.

What are other names for 3,5-Dimethyl-4-P-tolylsulfanyl-1H-pyrazole?

3,5-Dimethyl-4-P-tolylsulfanyl-1H-pyrazole is also known as 3,5-dimethyl-1H-pyrazol-4-yl 4-methylphenyl sulfide, 3,5-dimethyl-4-(4-methylphenyl)sulfanyl-1H-pyrazole, 3,5-dimethyl-4-(p-tolylthio)-1H-pyrazole, 3,5-dimethyl-4-[(4-methylphenyl)sulfanyl]-1H-pyrazole, 3,5-Dimethyl-4-[(4-methylphenyl)thio]-1H-pyrazole.

Data sourced from PubChem CID 746386. Last updated Apr 28, 2026.

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