Ethyl 2-cyano-2-phenylbutanoate

Basic Information

View in Editor

CAS Number

718-71-8

Molecular Formula

C13H15NO2

Molecular Weight

206.28 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Nitriles

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

SMILES

View in Editor

CCC(C#N)(C1=CC=CC=C1)C(=O)OCC

InChI

InChI=1S/C13H15NO2/c1-3-13(10-14,12(15)16-4-2)11-8-6-5-7-9-11/h5-9H,3-4H2,1-2H3

InChIKey

VCJAUIYSQAXNGB-UHFFFAOYSA-N

LogP

2.9174000000000015

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

286

Synonyms & References

English

N-(2,4-Dichloro-5-(4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1h-1,2,4-triazol-1-yl)phenyl)-n-(methylsulfonyl)methanesulfonamide
D81906
Ethyl 2-Phenyl-2-Cyanobutylate
DTXSID60290526
Ethylphenylcyano-acetic acid ethyl ester
Ethyl-2-phenyl-2-cyanobutylate
NSC69121
AKOS015890653
J-522816
NSC-69121
FT-0656881
EC 700-275-3
ethyl 2-cyano-2-ethyl-2-phenylacetate
SCHEMBL9214363
ETHYL CYANOETHYLPHENYLACETATE
VCJAUIYSQAXNGB-UHFFFAOYSA-N
ethyl ethylphenylcyanoacetate
NS00007215
ethyl 2-cyano-2-phenylbutanoate
MFCD00068977
718-71-8
DS-18350
NCIOpen2_003448
NSC 69121
CS-0152634
Ethyl 2-cyano-2-phenylbutanoate
(R,S)-Ethylphenylcyano-aceticacidethylester
ETHYL ETHYLPHENYLCYANOACETATE
ethylphenylcyano-acetic acid ethyl ester
(r,s)-2-cyano-2-phenyl-butyric acid ethyl ester
Ethyl 2-Phenyl-2-cyanobutyl acid ester

MDL Number

MFCD00068977

Customs Code

2926909090

FAQ

What is Ethyl 2-cyano-2-phenylbutanoate (CAS: 718-71-8)?

Ethyl 2-cyano-2-phenylbutanoate is a colorless liquid with a distinctive odor. It has the chemical formula C10H11NO2 and is used in various applications due to its unique properties.

What are the main uses of Ethyl 2-cyano-2-phenylbutanoate (CAS: 718-71-8)?

Ethyl 2-cyano-2-phenylbutanoate is primarily used as a precursor in the synthesis of pharmaceuticals and pesticides. It is also utilized in the production of flavors and fragrances, as well as in research applications.

Is Ethyl 2-cyano-2-phenylbutanoate (CAS: 718-71-8) safe?

Ethyl 2-cyano-2-phenylbutanoate is generally considered safe under normal conditions, but proper handling and storage are necessary. Users should avoid contact with skin and eyes, and wear appropriate personal protective equipment (PPE).

How should Ethyl 2-cyano-2-phenylbutanoate (CAS: 718-71-8) be stored?

Ethyl 2-cyano-2-phenylbutanoate should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a sealed container to prevent degradation. Avoid exposure to moisture and strong acids.