Chemical structure of CAS 122520-77-8

(2E)-2-cyano-3-(4-hydroxyphenyl)prop-2-enoic acid

CAS No.122520-77-8
MDL No.MFCD00004204
MFC10H7NO3
MW189.17
InChI KeyAFVLVVWMAFSXCK-VMPITWQZSA-N

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Product Information

Alpha-cyano-4-hydroxycinnamic acid is a monohydroxycinnamic acid derived from 4-hydroxycinnamic acid by replacing the hydrogen alpha to the carboxy group with a cyano group. It serves as a matrix in MALDI mass spectrometry for analyzing peptides and oligonucleotides. It is a nitrile, a phenol, and a monohydroxycinnamic acid.

CAS No.122520-77-8
Product Name(2E)-2-cyano-3-(4-hydroxyphenyl)prop-2-enoic acid
Heavy Atom Count14Rotatable Bond Count2
Atom Stereo Count0Bond Stereo Count1
HBA3HBD2
TPSA81.320 ŲCharge0
Exact Mass189.04259Complexity411.99
pKa3.187XLogP1.384