ChemicalBook--->CAS DataBase List--->28166-41-8

28166-41-8

28166-41-8 Structure

28166-41-8 Structure
IdentificationMore
[Name]

ALPHA-CYANO-4-HYDROXYCINNAMIC ACID
[CAS]

28166-41-8
[Synonyms]

2-CYANO-3-(4-HYDROXYPHENYL)ACRYLIC ACID
4-HCCA
ACCA
A-CYANO-4-HYDROXYCINNAMIC ACID
ALPHA-CCA
ALPHA-CHCA
ALPHA-CYANO
ALPHA-CYANO-4-HYDROXYCINNAMIC ACID
LABOTEST-BB LT00159295
alpha-cyano-4-hydroxycinnamate
ALPHA-CYANO-4-HYDROXYCINNAMIC ACID, USE
ALPHA-CYANO-4-HYDROXYCINNAMIC ACID PGE.WITH 10 X 25 MG
α-CCA, α-CHCA, α-Cyano, 4-HCCA, ACCA
2-Cyano-3-(4-hydroxyphenyl)propenoic acid
α-Cyano-4-hydroxybenzenepropenoic acid
[EINECS(EC#)]

248-879-1
[Molecular Formula]

C10H7NO3
[MDL Number]

MFCD00004204
[Molecular Weight]

189.17
[MOL File]

28166-41-8.mol
Chemical PropertiesBack Directory
[Appearance]

yellow crystalline powder
[Melting point ]

245-250 °C(lit.)
[Boiling point ]

324.41°C (rough estimate)
[density ]

1.3175 (rough estimate)
[refractive index ]

1.5400 (estimate)
[storage temp. ]

2-8°C
[solubility ]

methanol: 10 mg/mL, clear
[form ]

powder
[pka]

0.85±0.10(Predicted)
[color ]

yellow
[Water Solubility ]

H2O: slightly soluble
methanol: water: soluble
polar organic solvents: soluble
[BRN ]

3271427
[InChI]

InChI=1S/C10H7NO3/c11-6-8(10(13)14)5-7-1-3-9(12)4-2-7/h1-5,12H,(H,13,14)
[InChIKey]

AFVLVVWMAFSXCK-VMPITWQZSA-N
[SMILES]

C(O)(=O)C(C#N)=CC1=CC=C(O)C=C1
[CAS DataBase Reference]

28166-41-8(CAS DataBase Reference)
[Absorption]

≥2000 at 337nm (mol. absorption)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[F ]

10-23
[HS Code ]

29269090
Hazard InformationBack Directory
[Chemical Properties]

yellow crystalline powder
[Uses]

inhibitor of mitochondrial pyruvate transport
[Definition]

ChEBI: Alpha-cyano-4-hydroxycinnamic acid is a monohydroxycinnamic acid that is 4-hydroxycinnamic acid in which the hydrogen alpha- to the carboxy group is replaced by a cyano group. It is used as a matrix in matrix-assisted laser desorption/ionization (MALDI) mass spectrometry for the analysis of peptides and oligonucleotides. It has a role as a MALDI matrix material. It is a nitrile, a member of phenols and a monohydroxycinnamic acid.
[General Description]

α-Cyano-4-hydroxycinnamic acid is the commonly used matrix for analyzing peptides by matrix-assisted laser desorption/ionization mass spectrometry. It inhibits the monophenolase activity and diphenolase activity of mushroom tyrosinase.
[Biochem/physiol Actions]

α-Cyano-4-hydroxycinnamic acid acts as a specific inhibitor of monocarboxylic acid transport, including lactate and pyruvate transport. It is also reported to block β-cell apical anion exchange (IC50 of 2.4 mM).
[storage]

Store at -20°C
Spectrum DetailBack Directory
[Spectrum Detail]

ALPHA-CYANO-4-HYDROXYCINNAMIC ACID(28166-41-8)MS
ALPHA-CYANO-4-HYDROXYCINNAMIC ACID(28166-41-8)1HNMR
ALPHA-CYANO-4-HYDROXYCINNAMIC ACID(28166-41-8)13CNMR
ALPHA-CYANO-4-HYDROXYCINNAMIC ACID(28166-41-8)IR1
ALPHA-CYANO-4-HYDROXYCINNAMIC ACID(28166-41-8)IR2
ALPHA-CYANO-4-HYDROXYCINNAMIC ACID(28166-41-8)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

alpha-Cyano-4-hydroxycinnamic acid, 97%(28166-41-8)
[Sigma Aldrich]

28166-41-8(sigmaaldrich)
[TCI AMERICA]

alpha-Cyano-4-hydroxycinnamic Acid,>98.0%(LC)(T)(28166-41-8)
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