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3-Formyl-1-phenylindazole

HCID 21454781
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=Cc1nn(-c2ccccc2)c2ccccc12
InChIKey
KHAMHKVKTPRQFI-UHFFFAOYSA-N
Molecular formula
C14H10N2O
Average molar mass
222.24 g/mol

Names & identifiers

Preferred name
3-Formyl-1-phenylindazole
IUPAC
1-phenylindazole-3-carbaldehyde

Names & synonyms

3-formyl-1-phenylindazoleSCHEMBL717936KHAMHKVKTPRQFI-UHFFFAOYSA-N1-phenyl-1H-indazole-3-carbaldehydeDB-0845591186539-95-6

Database identifiers

PubChem CID
21454781

Properties

Computed structural properties

XLogP
3
Topological polar surface area
34.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
17
Formal charge
0
Complexity
275

Related reactions

3 records
New reaction record
HRID 436202 reaction equation
HRID 436202As reactantuspto-grants-1977_02
HRID 1574258 reaction equation
HRID 1574258As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 2090990 reaction equation
HRID 2090990As productuspto-grants-2013_05

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes