CAS No.56619-93-3,N-(3-METHOXYPHENYL)-2,2-DIMETHYLPROPANAMIDE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	56619-93-3
Name:	N-(3-METHOXYPHENYL)-2,2-DIMETHYLPROPANAMIDE
Article Data:	38

Formula:	C₁₂H₁₇NO₂
Molecular Weight:	207.272
Synonyms:	Propanamide, N-(3-methoxyphenyl)-2,2-dimethyl- (9CI);N-(3-methoxyphenyl)-2,2-dimethylpropanamide;2,2-Dimethyl-N-(3-methoxyphenyl)propanamide;
Density:	1.057 g/cm³
Melting Point:	125-126 °C
Boiling Point:	358.2 °C at 760 mmHg
Flash Point:	170.4 °C
PSA:	38.33000
LogP:	2.75280

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Specification

The N1-(3-methoxyphenyl)-2,2-dimethylpropanamide is an organic compound with the formula C₁₂H₁₇NO₂. The systematic name of this chemical is N-(3-methoxyphenyl)-2,2-dimethylpropanamide. With the CAS registry number 56619-93-3, it is also named as 3-(Methoxy)-N-(2,2-dimethylpropanoyl)aniline.

Physical properties about N1-(3-methoxyphenyl)-2,2-dimethylpropanamide are: (1)ACD/LogP: 2.48; (2)ACD/LogD (pH 5.5): 2.48; (3)ACD/LogD (pH 7.4): 2.48; (4)ACD/BCF (pH 5.5): 45.12; (5)ACD/BCF (pH 7.4): 45.12; (6)ACD/KOC (pH 5.5): 531.85; (7)ACD/KOC (pH 7.4): 531.86; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 29.54 Å²; (12)Index of Refraction: 1.535; (13)Molar Refractivity: 61.06 cm³; (14)Molar Volume: 196 cm³; (15)Polarizability: 24.2×10^-24cm³; (16)Surface Tension: 36.5 dyne/cm; (17)Density: 1.057 g/cm³; (18)Flash Point: 170.4 °C; (19)Enthalpy of Vaporization: 60.37 kJ/mol; (20)Boiling Point: 358.2 °C at 760 mmHg; (21)Vapour Pressure: 2.59E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Nc1cccc(OC)c1)C(C)(C)C
(2)InChI: InChI=1/C12H17NO2/c1-12(2,3)11(14)13-9-6-5-7-10(8-9)15-4/h5-8H,1-4H3,(H,13,14)
(3)InChIKey: DAFHCFQPQMYDFI-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C12H17NO2/c1-12(2,3)11(14)13-9-6-5-7-10(8-9)15-4/h5-8H,1-4H3,(H,13,14)
(5)Std. InChIKey: DAFHCFQPQMYDFI-UHFFFAOYSA-N