Benzoic acid, 2-cyano-,ethyl ester

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Names

[ Name ]:
Benzoic acid, 2-cyano-,ethyl ester

[Synonym ]:
2-Cyan-benzoesaeure-aethylester
ethyl o-cyanobenzoate
2-carbethoxybenzonitrile
MFCD03423595
ethyl cyanobenzoate
2-cyano-benzoic acid ethyl ester
Phthalsaeure-aethylester-nitril

Chemical & Physical Properties

[ Density]:
1.14g/cm3

[ Boiling Point ]:
308.5ºC at 760 mmHg

[ Melting Point ]:
63-67ºC(lit.)

[ Molecular Formula ]:
C₁₀H₉NO₂

[ Molecular Weight ]:
175.18400

[ Flash Point ]:
143.4ºC

[ Exact Mass ]:
175.06300

[ PSA ]:
50.09000

[ LogP ]:
1.73498

[ Index of Refraction ]:
1.528

MSDS

Click to get detail MSDS

Safety Information

[ Personal Protective Equipment ]:
Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter

[ Hazard Codes ]:
Xi

[ RIDADR ]:
NONH for all modes of transport

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

Ethanol
2-Carbamoylbenzoic acid
ETHYL ANTHRANILATE
Benzamide, 2-cyano-
2-Cyanobenzaldehyde
2-Cyanobenzoic acid
Ethyl iodide

DownStream

ethyl 2-formylbenzoate
2-Cyanobenzoic acid
Ethyl benzoate
1H-Isoindol-1-one,3-(hydroxyamino)-
Isoindolin-1-one

Articles

5-Membered N-heterocyclic compounds by dimethyl carbonate chemistry. Arico F, et al.

Green Chem. 14(1) , 58-61, (2012)

Effect of ortho substituents on carbonyl carbon 13C NMR chemical shifts in substituted phenyl benzoates. Nummert V, et al.

J. Phys. Org. Chem. 22(12) , 1155-1165, (2009)

Benzoic acid, 2-amino-4-cyano-, ethyl ester (9CI)
Nonanoic acid,2-cyano-, ethyl ester
Hexanoic acid,2-cyano-, ethyl ester
Cyclobutanecarboxylic acid, 2-cyano-, ethyl ester, trans- (9CI)
Ethyl 2-cyano-5-methylbenzoate
Ethyl 2-cyano-3-methylbenzoate
(2Z)-2-(3-fluorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 4-methylbenzenesulfonate
2-fluoro-N-((6-(1-methyl-1H-pyrazol-5-yl)pyridin-3-yl)methyl)benzenesulfonamide
(Z)-methyl 2-((2-(4-ethoxybenzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl)oxy)propanoate
3,5-dimethyl-N-((6-(1-methyl-1H-pyrazol-5-yl)pyridin-3-yl)methyl)isoxazole-4-sulfonamide
[1-(4-bromophenyl)-6,6-dimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indol-2-yl]acetic acid
5-chloro-2-methoxy-N-((6-(1-methyl-1H-pyrazol-5-yl)pyridin-3-yl)methyl)benzenesulfonamide
2-[(5Z)-2,4-dioxo-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]-N-[(3S,4R)-4-hydroxytetrahydrothiophen-3-yl]acetamide
4-methyl-N-((6-(1-methyl-1H-pyrazol-5-yl)pyridin-3-yl)methyl)benzenesulfonamide
(Z)-2-(4-ethylbenzylidene)-6-(2-oxopropoxy)benzofuran-3(2H)-one
3-methyl-N-((6-(1-methyl-1H-pyrazol-5-yl)pyridin-3-yl)methyl)-2-oxo-2,3-dihydrobenzo[d]oxazole-5-sulfonamide

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