Name: 4-(2-Methoxyethyl)aniline
SKU: 84803-56-5

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Basic Information

Molecular Structure:
CAS No.:	84803-56-5
Name:	4-(2-Methoxyethyl)aniline
Article Data:	7

Formula:	C₉H₁₃NO
Molecular Weight:	151.208
Synonyms:	p-(2-Methoxyethyl)aniline;
EINECS:	284-182-9
Density:	1.025 g/cm³
Boiling Point:	242.3 °C at 760 mmHg
Flash Point:	100.9 °C
PSA:	35.25000
LogP:	2.03890

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Specification

The 4-(2-Methoxyethyl)aniline, with the CAS registry number 84803-56-5, is also known as p-(2-Methoxyethyl)aniline. Its EINECS registry number is 284-182-9. This chemical's molecular formula is C₉H₁₃NO and molecular weight is 151.2056. What's more, its IUPAC name is 4-(2-Methoxyethyl)aniline.

Physical properties about 4-(2-Methoxyethyl)aniline are: (1)ACD/LogP: 0.86; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.79; (4)ACD/LogD (pH 7.4): 0.86; (5)ACD/BCF (pH 5.5): 2.24; (6)ACD/BCF (pH 7.4): 2.64; (7)ACD/KOC (pH 5.5): 59.03; (8)ACD/KOC (pH 7.4): 69.75; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 12.47 Å²; (13)Index of Refraction: 1.542; (14)Molar Refractivity: 46.41 cm³; (15)Molar Volume: 147.4 cm³; (16)Polarizability: 18.4×10^-24 cm³; (17)Surface Tension: 39.3 dyne/cm; (18)Density: 1.025 g/cm³; (19)Flash Point: 100.9 °C; (20)Enthalpy of Vaporization: 47.93 kJ/mol; (21)Boiling Point: 242.3 °C at 760 mmHg; (22)Vapour Pressure: 0.0342 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O(CCc1ccc(N)cc1)C
(2) InChI: InChI=1/C9H13NO/c1-11-7-6-8-2-4-9(10)5-3-8/h2-5H,6-7,10H2,1H3
(3) InChIKey: LGBFKALRQPQBJJ-UHFFFAOYAM