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Benzoic acid,2-(dimethylamino)-, ethyl ester (55426-74-9)

Identification
Name:Benzoic acid,2-(dimethylamino)-, ethyl ester
Synonyms:Ethyl2-(dimethylamino)benzoate;Ethyl o-dimethylaminobenzoate;Quantacure EOB;o-Ethyl N,N-dimethylaminobenzoate;
CAS:55426-74-9
EINECS: 259-634-3
Molecular Formula: C11H15NO2
Molecular Weight: 193.2423
InChI: InChI=1/C11H15NO2/c1-4-14-11(13)9-7-5-6-8-10(9)12(2)3/h5-8H,4H2,1-3H3
Molecular Structure: (C11H15NO2) Ethyl2-(dimethylamino)benzoate;Ethyl o-dimethylaminobenzoate;Quantacure EOB;o-Ethyl N,N-dimethylamin...
Properties
Flash Point: 98 ºC
Density:1.061
Refractive index:1.537-1.539
Appearance:clear yellow to straw yellow liquid
Specification:

The cas register number of Ethyl 2-dimethylaminobenzoate is 55426-74-9. It also can be called as Benzoic acid,2-(dimethylamino)-, ethyl ester and the IUPAC Name about this chemical is ethyl 2-(dimethylamino)benzoate. This chemical is irritating to eyes, respiratory system and skin. When you are using it, please avoid contact with skin and eyes.

Physical properties about Ethyl 2-dimethylaminobenzoate are: (1)ACD/LogP: 2.65; (2)ACD/LogD (pH 5.5): 2.64; (3)ACD/LogD (pH 7.4): 2.65; (4)ACD/BCF (pH 5.5): 59.16; (5)ACD/BCF (pH 7.4): 60.42; (6)ACD/KOC (pH 5.5): 641.83; (7)ACD/KOC (pH 7.4): 655.45; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 29.54Å2; (11)Index of Refraction: 1.539; (12)Molar Refractivity: 56.97 cm3; (13)Molar Volume: 181.8 cm3; (14)Polarizability: 22.58x10-24cm3; (15)Surface Tension: 38.8 dyne/cm; (16)Enthalpy of Vaporization: 52 kJ/mol; (17)Vapour Pressure: 0.00362 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC)c1ccccc1N(C)C
(2)InChI: InChI=1/C11H15NO2/c1-4-14-11(13)9-7-5-6-8-10(9)12(2)3/h5-8H,4H2,1-3H3
(3)InChIKey: ORBFAMHUKZLWSD-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C11H15NO2/c1-4-14-11(13)9-7-5-6-8-10(9)12(2)3/h5-8H,4H2,1-3H3
(5)Std. InChIKey: ORBFAMHUKZLWSD-UHFFFAOYSA-N

Flash Point: 98 ºC
Safety Data