1-tosyl-1H-pyrazole-4-carbaldehyde

HCID 57743031
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1ccc(S(=O)(=O)n2cc(C=O)cn2)cc1
InChIKey
LMWAAHSSVASYRM-UHFFFAOYSA-N
Molecular formula
C11H10N2O3S
Average molar mass
250.28 g/mol

Names & identifiers

Preferred name
1-tosyl-1H-pyrazole-4-carbaldehyde
IUPAC
1-(4-methylphenyl)sulfonylpyrazole-4-carbaldehyde

Names & synonyms

1-tosyl-1H-pyrazole-4-carbaldehydeSCHEMBL568158LMWAAHSSVASYRM-UHFFFAOYSA-N916257-05-1DB-2915341-(toluene-4-sulfonyl)-1H-pyrazole-4-carbaldehyde1-[(4-methylphenyl)sulfonyl]-1H-pyrazole-4-carbaldehyde

Database identifiers

PubChem CID
57743031

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
77.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
17

Related reactions

9 records
New reaction record

Compound notes

Loading…