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19672-02-7

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Basic Information
CAS No.: 19672-02-7
Name: 2-ETHYL-5-METHOXYPHENOL
Article Data: 7
Molecular Structure:
Molecular Structure of 19672-02-7 (2-ETHYL-5-METHOXYPHENOL)
Formula: C9H12O2
Molecular Weight: 152.193
Synonyms: 2-Ethyl-5-methoxyphenol;5-Methoxy-2-ethylphenol;
Density: 1.052 g/cm3
Boiling Point: 256.956 °C at 760 mmHg
Flash Point: 121.614 °C
PSA: 29.46000
LogP: 1.96320
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Specification

The Phenol,2-ethyl-5-methoxy- is an organic compound with the formula C9H12O2. With the CAS registry number 19672-02-7, the systematic name of this chemical is 2-ethyl-5-methoxyphenol.

Physical properties about Phenol,2-ethyl-5-methoxy- are: (1)ACD/LogP: 2.65; (2)ACD/LogD (pH 5.5): 3; (3)ACD/LogD (pH 7.4): 3; (4)ACD/BCF (pH 5.5): 47; (5)ACD/BCF (pH 7.4): 47; (6)ACD/KOC (pH 5.5): 550; (7)ACD/KOC (pH 7.4): 549; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 29.46 Å2; (12)Index of Refraction: 1.525; (13)Molar Refractivity: 44.362 cm3; (14)Molar Volume: 144.683 cm3; (15)Polarizability: 17.587×10-24cm3; (16)Surface Tension: 36.471 dyne/cm; (17)Density: 1.052 g/cm3; (18)Flash Point: 121.614 °C; (19)Enthalpy of Vaporization: 51.447 kJ/mol; (20)Boiling Point: 256.956 °C at 760 mmHg; (21)Vapour Pressure: 0.009 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CCc1ccc(cc1O)OC
(2)InChI: InChI=1/C9H12O2/c1-3-7-4-5-8(11-2)6-9(7)10/h4-6,10H,3H2,1-2H3
(3)InChIKey: HPURPVUTEGLILL-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C9H12O2/c1-3-7-4-5-8(11-2)6-9(7)10/h4-6,10H,3H2,1-2H3
(5)Std. InChIKey: HPURPVUTEGLILL-UHFFFAOYSA-N