5-Ethyl-1-isopropyl-1H-pyrazole-4-carbaldehyde

HCID 21097341
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CCc1c(C=O)cnn1C(C)C
InChIKey
SEVPKOIVDSHWEI-UHFFFAOYSA-N
Molecular formula
C9H14N2O
Average molar mass
166.22 g/mol

Names & identifiers

Preferred name
5-Ethyl-1-isopropyl-1H-pyrazole-4-carbaldehyde
IUPAC
5-ethyl-1-propan-2-ylpyrazole-4-carbaldehyde

Names & synonyms

SCHEMBL4035529SEVPKOIVDSHWEI-UHFFFAOYSA-N5-Ethyl-1-isopropyl-1H-pyrazole-4-carbaldehyde

Database identifiers

PubChem CID
21097341

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
34.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
12

Related reactions

3 records
New reaction record

Compound notes

Loading…