Home Other Building Blocks 3-(4-Chlorophenyl)-2-cyanoacrylic acid

3-(4-Chlorophenyl)-2-cyanoacrylic acid

CAS No.:
20374-46-3
Catalog Number:
AG00293Y
Molecular Formula:
C10H6ClNO2
Molecular Weight:
207.6131
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
≥98%
1 week
United States
$96
- +
10mg
≥98%
1 week
United States
$135
- +
25mg
≥98%
1 week
United States
$232
- +
50mg
≥98%
1 week
United States
$368
- +
Product Description
Catalog Number:
AG00293Y
Chemical Name:
3-(4-Chlorophenyl)-2-cyanoacrylic acid
CAS Number:
20374-46-3
Molecular Formula:
C10H6ClNO2
Molecular Weight:
207.6131
MDL Number:
MFCD02317172
IUPAC Name:
(E)-3-(4-chlorophenyl)-2-cyanoprop-2-enoic acid
InChI:
InChI=1S/C10H6ClNO2/c11-9-3-1-7(2-4-9)5-8(6-12)10(13)14/h1-5H,(H,13,14)/b8-5+
InChI Key:
MXCRRKYUQNHWLJ-VMPITWQZSA-N
SMILES:
N#C/C(=C\c1ccc(cc1)Cl)/C(=O)O
Properties
Complexity:
295  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
207.009g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
207.613g/mol
Monoisotopic Mass:
207.009g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
61.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Literature
Title Journal
Ion yields in UV-MALDI mass spectrometry as a function of excitation laser wavelength and optical and physico-chemical properties of classical and halogen-substituted MALDI matrixes. Analytical chemistry 20120807
MALDI-TOF-MS analysis of sialylated glycans and glycopeptides using 4-chloro-α-cyanocinnamic acid matrix. Proteomics 20120501
Compelling evidence for Lucky Survivor and gas phase protonation: the unified MALDI analyte protonation mechanism. Journal of the American Society for Mass Spectrometry 20110601
Evaluation of the new MALDI matrix 4-chloro-alpha-cyanocinnamic acid. Journal of biomolecular techniques : JBT 20100701
Peptide mass fingerprinting after less specific in-gel proteolysis using MALDI-LTQ-Orbitrap and 4-chloro-alpha-cyanocinnamic acid. Journal of proteome research 20100507
Introduction of 4-chloro-alpha-cyanocinnamic acid liquid matrices for high sensitivity UV-MALDI MS. Journal of proteome research 20100405
Modification of phosphatidylserine by hypochlorous acid. Chemistry and physics of lipids 20090901
Comparison between the matrices alpha-cyano-4-hydroxycinnamic acid and 4-chloro-alpha-cyanocinnamic acid for trypsin, chymotrypsin, and pepsin digestions by MALDI-TOF mass spectrometry. Journal of proteome research 20090701
The new matrix 4-chloro-alpha-cyanocinnamic acid allows the detection of phosphatidylethanolamine chloramines by MALDI-TOF mass spectrometry. Journal of the American Society for Mass Spectrometry 20090501
Properties