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Home Nitriles (Triphenylphosphoranylidene)acetonitrile

(Triphenylphosphoranylidene)acetonitrile

CAS No.:
16640-68-9
Catalog Number:
AG001WPO
Molecular Formula:
C20H16NP
Molecular Weight:
301.3215
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$38
- +
5g
95%
In Stock USA
United States
$119
- +
25g
95%
In Stock USA
United States
$438
- +
Product Description
Catalog Number:
AG001WPO
Chemical Name:
(Triphenylphosphoranylidene)acetonitrile
CAS Number:
16640-68-9
Molecular Formula:
C20H16NP
Molecular Weight:
301.3215
MDL Number:
MFCD00567633
IUPAC Name:
2-(triphenyl-λ5-phosphanylidene)acetonitrile
InChI:
InChI=1S/C20H16NP/c21-16-17-22(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,17H
InChI Key:
APISVOVOJVZIBA-UHFFFAOYSA-N
SMILES:
N#CC=P(c1ccccc1)(c1ccccc1)c1ccccc1
EC Number:
240-689-7
NSC Number:
135204
Properties
Complexity:
387  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.102g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.329g/mol
Monoisotopic Mass:
301.102g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Literature
Title Journal
Four-component reaction of N-sulfonylimines, (cyanomethylene)triphenylphosphorane, nitromethane, and formaldehyde for the synthesis of 3-substituted 2-methylene-4-nitrobutanenitriles. The Journal of organic chemistry 20110520
Synthesis of tetrazole analogs of gamma- and delta-amino acids. Journal of peptide science : an official publication of the European Peptide Society 20060601
Asymmetric synthesis of (+)-hypusine. Organic letters 20011227
Properties