3-Anilinopropionitrile (C9H10N2)

3-Anilinopropionitrile presents a C9 framework, aromatic rings, basic nitrogen (formula C9H10N2, CAS 1075-76-9). ChemicalTool Reaction can propose ranked disconnections for 3-Anilinopropionitrile from the SMILES N#CCCNc1ccccc1.

Target: 3-Anilinopropionitrile
CAS: 1075-76-9
Formula: C9H10N2
Approx. MW: 146.19
SMILES: N#CCCNc1ccccc1
PubChem CID: 14100
Approx. carbons: C9

3-Anilinopropionitrile structure

Properties

IUPAC name: 3-anilinopropanenitrile
Common names: 3-Anilinopropionitrile; 3-(phenylamino)propanenitrile; 3-Anilinopropanenitrile; Propanenitrile, 3-(phenylamino)-; 3-(phenylamino)propionitrile; 3-Phenylamino-propionitrile; EINECS 214-057-6; BRN 0509166; S4YM38H4U6; NSC-80663
Molecular weight: 146.19
Exact mass: 146.08
InChIKey: FENJKTQEFUPECW-UHFFFAOYSA-N

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3-Anilinopropionitrile 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 3-Anilinopropionitrile?

3-Anilinopropionitrile has molecular formula C9H10N2. Molecular weight about 146.19 g·mol⁻¹.

What is the CAS number of 3-Anilinopropionitrile?

The CAS Registry Number for 3-Anilinopropionitrile is 1075-76-9.

Run AI retrosynthesis for 3-Anilinopropionitrile Target catalog AI tools overview

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Related targets

Similar compounds

(S)-adrenaline 1,2,3,4-tetrahydroquinoline 2-Amino-6-Ethoxybenzothiazole 2-Isopropylaniline 2-Methoxyphenethylamine 2-Phenylpropionitrile

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References & tools

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