3-APDPO cpd (C9H9N3O)

3-APDPO cpd presents a C9 framework, basic nitrogen (formula C9H9N3O, CAS 4149-06-8). ChemicalHelper Reaction can propose ranked disconnections for 3-APDPO cpd from the SMILES NC1=NN(c2ccccc2)C(=O)C1.

Target: 3-APDPO cpd
CAS: 4149-06-8
Formula: C9H9N3O
Approx. MW: 175.19
SMILES: NC1=NN(c2ccccc2)C(=O)C1
PubChem CID: 77794
Approx. carbons: C9

3-APDPO cpd structure

Properties

IUPAC name: 5-amino-2-phenyl-4H-pyrazol-3-one
Common names: 3-amino-1-phenyl-4,5-dihydro-1h-pyrazol-5-one; 3-APDPO cpd; RefChem:911121; 3-amino-1-phenyl-2-pyrazolin-5-one; 4149-06-8; 3-Amino-1-phenyl-1H-pyrazol-5(4H)-one; 5-amino-2-phenyl-4H-pyrazol-3-one; 3H-Pyrazol-3-one, 5-amino-2,4-dihydro-2-phenyl-; 5-Amino-2-phenyl-2,4-dihydro-3H-pyrazol-3-one; 1-Phenyl-3-amino-2-pyrazolin-5-one
Molecular weight: 175.19
Exact mass: 175.07
InChIKey: LPOVZHYARSAVIZ-UHFFFAOYSA-N

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3-APDPO cpd 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 3-APDPO cpd?

3-APDPO cpd has molecular formula C9H9N3O. Molecular weight about 175.19 g·mol⁻¹.

What is the CAS number of 3-APDPO cpd?

The CAS Registry Number for 3-APDPO cpd is 4149-06-8.

Run AI retrosynthesis for 3-APDPO cpd Target catalog AI tools overview

Start from this SMILES and explore AI retrosynthesis routes for C9H9N3O.

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1-(methylsulfonyl)indoline 3-(triethoxysilyl)propionitrile 3-Aminopropyltriethoxysilane Cyclohexylisopropylamine Di-tert-butylcarbodiimide Ethyl 1-methylpiperidine-3-carboxylate

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References & tools

ChemicalHelper Reaction — AI retrosynthesis with optional library evidence.
PubChem — compound identifiers and structure depictions (NIH/NCBI).
Related: AiZynthFinder / synthesis planning literature for computer-aided retrosynthesis.