Home Other Building Blocks Ethyl cyanoformate

Ethyl cyanoformate

CAS No.:
623-49-4
Catalog Number:
AG0034VZ
Molecular Formula:
C4H5NO2
Molecular Weight:
99.0880
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$13
- +
25g
96%
In Stock USA
United States
$50
- +
100g
96%
In Stock USA
United States
$138
- +
500g
96%
In Stock USA
United States
$525
- +
Product Description
Catalog Number:
AG0034VZ
Chemical Name:
Ethyl cyanoformate
CAS Number:
623-49-4
Molecular Formula:
C4H5NO2
Molecular Weight:
99.0880
MDL Number:
MFCD00001836
IUPAC Name:
ethyl cyanoformate
InChI:
InChI=1S/C4H5NO2/c1-2-7-4(6)3-5/h2H2,1H3
InChI Key:
MSMGXWFHBSCQFB-UHFFFAOYSA-N
SMILES:
CCOC(=O)C#N
EC Number:
210-797-9
UNII:
I56GWI2QQ5
NSC Number:
65347
Properties
Complexity:
110  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
99.032g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
99.089g/mol
Monoisotopic Mass:
99.032g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Literature
Title Journal
A highly enantioselective catalytic Strecker reaction of cyclic (Z)-aldimines. Chemical communications (Cambridge, England) 20120518
C2-symmetric recyclable organocatalyst for enantioselective Strecker reaction for the synthesis of α-amino acid and chiral diamine--an intermediate for APN inhibitor. The Journal of organic chemistry 20120504
Enantioselective trapping of an α-chiral carbanion of acyclic nitrile by a carbon electrophile. Chemical communications (Cambridge, England) 20120318
Asymmetric cyanation of activated olefins with ethyl cyanoformate catalyzed by a modular titanium catalyst. Organic letters 20100319
Enantioselective cyanoformylation of aldehydes catalyzed with solid base mediated chiral V(V) salen complexes. Chirality 20100101
Asymmetric cyanation of aldehydes, ketones, aldimines, and ketimines catalyzed by a versatile catalyst generated from cinchona alkaloid, achiral substituted 2,2'-biphenol and tetraisopropyl titanate. Chemistry (Weinheim an der Bergstrasse, Germany) 20091102
Dual-activation asymmetric strecker reaction of aldimines and ketimines catalyzed by a tethered bis(8-quinolinolato) aluminum complex. Journal of the American Chemical Society 20091028
Conformer lifetimes of ethyl cyanoformate from exchange-averaged rotational spectra. The journal of physical chemistry. A 20090625
Cyanide ion promoted addition of acyl phosphonates to ethyl cyanoformate: synthesis of tertiary carbinols via tandem carbon-carbon bond formations. The Journal of organic chemistry 20070914
Synthesis of alpha-keto esters by the rhodium-catalysed reaction of cyanoformate with arylboronic acids. Chemical communications (Cambridge, England) 20070719
Evidence of conformational exchange averaging in the thermal rotational spectrum of ethyl cyanoformate. The journal of physical chemistry. A 20060615
Synthesis, structure and reactivity of 5-pyranosyl-1,3,4-oxathiazol-2-ones. Carbohydrate research 20060116
Dual Lewis acid-Lewis base activation in enantioselective cyanation of aldehydes using acetyl cyanide and cyanoformate as cyanide sources. Journal of the American Chemical Society 20050824
Catalytic asymmetric cyano-ethoxycarbonylation reaction of aldehydes using a YLi3 tris(binaphthoxide) (YLB) complex: mechanism and roles of achiral additives. Journal of the American Chemical Society 20050316
Cp*RuCl-catalyzed [2 + 2 + 2] cycloadditions of alpha,omega-diynes with electron-deficient carbon-heteroatom multiple bonds leading to heterocycles. Journal of the American Chemical Society 20050119
Catalytic, asymmetric synthesis of cyanohydrin ethyl carbonates. Organic letters 20031113
2-azabicyclo[2.2.2]octa-3,5-dione via a nitrile Diels-Alder reaction. The Journal of organic chemistry 20031017
Properties