3-ethyl-1-methyl-1H-pyrazole-4-carbaldehyde
Basic information
- CAS
1007541-41-4- Standard SMILES
CCc1nn(C)cc1C=O- InChIKey
DBEPQQVNUCSVCF-UHFFFAOYSA-N- Molecular formula
- C7H10N2O
- Average molar mass
- 138.17 g/mol
- Monoisotopic mass
- 138.07931295
Names & identifiers
- Preferred name
- 3-ethyl-1-methyl-1H-pyrazole-4-carbaldehyde
- IUPAC
- 3-ethyl-1-methylpyrazole-4-carbaldehyde
Names & synonyms
3-ethyl-1-methyl-1H-pyrazole-4-carbaldehyde1007541-41-4RefChem:501276873-856-33-ethyl-1-methylpyrazole-4-carbaldehydeSCHEMBL29339717HQB54141MFCD08700634AKOS0036726733-ethyl-1-methyl-pyrazole-4-carbaldehydeSY150340CS-0225464
Show more names
EN300-123955G22119Z1198181502
Database identifiers
- CAS
1007541-41-4- PubChem CID
- 23005658
- EC Number
- 873-856-3
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 34.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 127
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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 CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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