4-(thiophen-3-yl)-1H-pyrazole
Basic information
- CAS
76153-71-4- Standard SMILES
c1cc(-c2cn[nH]c2)cs1- InChIKey
QCHPFTILUWYZIO-UHFFFAOYSA-N- Molecular formula
- C7H6N2S
- Average molar mass
- 150.2 g/mol
- Monoisotopic mass
- 150.02516937
Names & identifiers
- Preferred name
- 4-(thiophen-3-yl)-1H-pyrazole
- IUPAC
- 4-thiophen-3-yl-1H-pyrazole
Names & synonyms
4-(thiophen-3-yl)-1H-pyrazole76153-71-4RefChem:517017828-754-34-thien-3-yl-1H-pyrazole4-thiophen-3-yl-1H-pyrazole3-pyrazol-4-ylthiophene4-(3-thienyl)-1h-pyrazoleSCHEMBL7262464SCHEMBL18955827BDA15371MFCD01859937
Show more names
SBB086725AKOS006276849CS-0237502G54824EN300-1844775AI-942/25034360Z1198158858
Database identifiers
- CAS
76153-71-4- PubChem CID
- 818921
- EC Number
- 828-754-3
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 56.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 118
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
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Related reactions
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Compound notes
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