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14531-52-3

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Basic Information
CAS No.: 14531-52-3
Name: Dihydropinosylvin
Article Data: 11
Molecular Structure:
Molecular Structure of 14531-52-3 (Dihydropinosylvin)
Formula: C14H14O2
Molecular Weight: 214.264
Synonyms: Resorcinol,5-phenethyl- (6CI,7CI,8CI);5-Phenethylresorcinol;Dihydropinosylvin;5-(2-Phenylethyl)benzene-1,3-diol;
EINECS: 1312995-182-4
Density: 1.191 g/cm3
Boiling Point: 366 °C at 760 mmHg
Flash Point: 175.7 °C
PSA: 40.46000
LogP: 2.88300
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Specification

The 1,3-Benzenediol,5-(2-phenylethyl)-, with the CAS registry number 14531-52-3, is also known as Dihydropinosylvin. This chemical's molecular formula is C14H14O2 and molecular weight is 214.26. What's more, its systematic name is 5-(2-Phenylethyl)benzene-1,3-diol.

Physical properties of 1,3-Benzenediol,5-(2-phenylethyl)- are: (1)ACD/LogP: 3.24; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 18.46 Å2; (7)Index of Refraction: 1.63; (8)Molar Refractivity: 64.05 cm3; (9)Molar Volume: 179.8 cm3; (10)Polarizability: 25.39×10-24 cm3; (11)Surface Tension: 53.3 dyne/cm; (12)Density: 1.191 g/cm3; (13)Flash Point: 175.7 °C; (14)Enthalpy of Vaporization: 63.64 kJ/mol; (15)Boiling Point: 366 °C at 760 mmHg; (16)Vapour Pressure: 7.18E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C(C=C1)CCC2=CC(=CC(=C2)O)O
(2)InChI: InChI=1S/C14H14O2/c15-13-8-12(9-14(16)10-13)7-6-11-4-2-1-3-5-11/h1-5,8-10,15-16H,6-7H2
(3)InChIKey: LDBYHULIXFIJAZ-UHFFFAOYSA-N