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3-cyanobenzoic acid

Molecular Formula:

C8H5NO2

Molecular Weight:

147.133 g/mol

Registry Numbers

Cas Number: 1877-72-1

EINECS Number: 217-511-1

MDL Number: MFCD00002486

InChIKey:

GYLKKXHEIIFTJH-KZFATGLACK

Smiles:

OC(=O)C1=CC(=CC=C1)C#N

Chemical structure of 3-cyanobenzoic acid

Synthesis Reference

Tetrahedron Letters, 29, p. 2589, 1988 DOI: 10.1016/S0040-4039(00)86119-5

Synonym Chemical Name(s)

3-cyano-benzoic acid
3-cyanobenzoesäure
acide 3-cyanobenzoic
3-シアノ安息香酸

Physical Properties

Melting Point: 217-222 ºC
Boiling Point: n/a

Density: n/a
Refractive Index: n/a

H1 NMR Spectrum:

Predict NMR spectrum

MSDS:

coming soon

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