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38998-04-8

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Basic Information
CAS No.: 38998-04-8
Name: 4-HYDROXY-7-METHOXYINDAN
Article Data: 3
Molecular Structure:
Molecular Structure of 38998-04-8 (4-HYDROXY-7-METHOXYINDAN)
Formula: C10H12O2
Molecular Weight: 164.204
Synonyms: 4-Indanol,7-methoxy- (6CI);4-Methoxy-7-indanol;7-Methoxy-4-indanol;
Density: 1.164 g/cm3
Boiling Point: 320.1 °C at 760 mmHg
Flash Point: 197.1 °C
PSA: 29.46000
LogP: 1.88950
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Specification

The 1H-Inden-4-ol,2,3-dihydro-7-methoxy- is an organic compound with the formula C10H12O2. The systematic name of this chemical is 7-methoxy-2,3-dihydro-1H-inden-4-ol. With the CAS registry number 38998-04-8, it is also named as 4-Hydroxy-7-methoxyindane.

Physical properties about 1H-Inden-4-ol,2,3-dihydro-7-methoxy- are: (1)ACD/LogP: 2.43; (2)ACD/LogD (pH 5.5): 2.43; (3)ACD/LogD (pH 7.4): 2.43; (4)ACD/BCF (pH 5.5): 41.43; (5)ACD/BCF (pH 7.4): 41.42; (6)ACD/KOC (pH 5.5): 500.36; (7)ACD/KOC (pH 7.4): 500.2; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 29.46 Å2; (12)Index of Refraction: 1.581; (13)Molar Refractivity: 46.98 cm3; (14)Molar Volume: 140.9 cm3; (15)Polarizability: 18.62×10-24cm3; (16)Surface Tension: 45 dyne/cm; (17)Density: 1.164 g/cm3; (18)Flash Point: 197.1 °C; (19)Enthalpy of Vaporization: 58.41 kJ/mol; (20)Boiling Point: 320.1 °C at 760 mmHg; (21)Vapour Pressure: 0.000174 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Oc1ccc(OC)c2CCCc12
(2)InChI: InChI=1/C10H12O2/c1-12-10-6-5-9(11)7-3-2-4-8(7)10/h5-6,11H,2-4H2,1H3
(3)InChIKey: MUYRQNYFMUEYKP-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C10H12O2/c1-12-10-6-5-9(11)7-3-2-4-8(7)10/h5-6,11H,2-4H2,1H3
(5)Std. InChIKey: MUYRQNYFMUEYKP-UHFFFAOYSA-N