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182499-90-7

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Basic Information
CAS No.: 182499-90-7
Name: Phenol, 2-amino-5-ethyl- (9CI)
Article Data: 5
Molecular Structure:
Molecular Structure of 182499-90-7 (Phenol, 2-amino-5-ethyl- (9CI))
Formula: C8H11NO
Molecular Weight: 137.181
Synonyms: 2-Amino-5-ethyl phenol;
Density: 1.116 g/cm3
Boiling Point: 254.829 °C at 760 mmHg
Flash Point: 107.917 °C
PSA: 46.25000
LogP: 2.11800
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Specification

The 2-Amino-5-ethylphenol, with the CAS registry number 182499-90-7, is also known as Furo[3,4-b]pyridine-5,7-dione, 3-ethyl-. It belongs to the product category of Alcohol. This chemical's molecular formula is C8H11NO and molecular weight is 137.18. What's more, its systematic name is 2-Amino-5-ethylphenol.

Physical properties of 2-Amino-5-ethylphenol are: (1)ACD/LogP: 1.364; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.17; (4)ACD/LogD (pH 7.4): 1.36; (5)ACD/BCF (pH 5.5): 4.08; (6)ACD/BCF (pH 7.4): 6.29; (7)ACD/KOC (pH 5.5): 83.78; (8)ACD/KOC (pH 7.4): 129.22; (9)#H bond acceptors: 2; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 46.25 Å2; (13)Index of Refraction: 1.597; (14)Molar Refractivity: 41.92 cm3; (15)Molar Volume: 122.961 cm3; (16)Polarizability: 16.618×10-24cm3; (17)Surface Tension: 48.6 dyne/cm; (18)Density: 1.116 g/cm3; (19)Flash Point: 107.917 °C; (20)Enthalpy of Vaporization: 51.217 kJ/mol; (21)Boiling Point: 254.829 °C at 760 mmHg; (22)Vapour Pressure: 0.01 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Oc1cc(ccc1N)CC
(2)Std. InChI: InChI=1S/C8H11NO/c1-2-6-3-4-7(9)8(10)5-6/h3-5,10H,2,9H2,1H3
(3)Std. InChIKey: VBCFPAKCBOGUBW-UHFFFAOYSA-N