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Home Nitriles Fumaronitrile

Fumaronitrile

CAS No.:
764-42-1
Catalog Number:
AG0034YJ
Molecular Formula:
C4H2N2
Molecular Weight:
78.0721
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$15
- +
5g
98%
In Stock USA
United States
$49
- +
25g
98%
In Stock USA
United States
$188
- +
100g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG0034YJ
Chemical Name:
Fumaronitrile
CAS Number:
764-42-1
Molecular Formula:
C4H2N2
Molecular Weight:
78.0721
MDL Number:
MFCD00001928
IUPAC Name:
(E)-but-2-enedinitrile
InChI:
InChI=1S/C4H2N2/c5-3-1-2-4-6/h1-2H/b2-1+
InChI Key:
KYPOHTVBFVELTG-OWOJBTEDSA-N
SMILES:
N#C/C=C/C#N
EC Number:
212-122-3
NSC Number:
17555
UN Number:
3439
Properties
Complexity:
119  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
78.022g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
78.074g/mol
Monoisotopic Mass:
78.022g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Literature
Title Journal
Population-based in vitro hazard and concentration-response assessment of chemicals: the 1000 genomes high-throughput screening study. Environmental health perspectives 20150501
Ultrabright and ultrastable near-infrared dye nanoparticles for in vitro and in vivo bioimaging. Biomaterials 20121101
2H-Azirines from a concerted addition of alkylcarbenes to nitrile groups. Organic letters 20100521
Synthesis, structural characterization, and unusual field-effect behavior of organic transistor semiconductor oligomers: inferiority of oxadiazole compared with other electron-withdrawing subunits. Journal of the American Chemical Society 20090211
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties