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Phenol,3-methoxy-5-(2-phenylethyl)-

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Name

Phenol,3-methoxy-5-(2-phenylethyl)-

EINECS N/A
CAS No. 17635-59-5 Density 1.111 g/cm3
PSA 29.46000 LogP 3.18600
Solubility N/A Melting Point 49-53°C
Formula C15H16O2 Boiling Point 368.7 °C at 760 mmHg
Molecular Weight 228.291 Flash Point 194.3 °C
Transport Information N/A Appearance N/A
Safety 26-61 Risk Codes 22-36-51/53
Molecular Structure Molecular Structure of 17635-59-5 (DIHYDROPINOSYLVIN MONOMETHYL ETHER) Hazard Symbols Xn,N
Synonyms

Dihydropinosylvin methyl ether;Dihydropinosylvinmonomethyl ether;Pinosylvin, dihydro-, methyl ether;Phenol,3-methoxy-5-phenethyl- (6CI,8CI);3-Hydroxy-5-methoxybibenzyl;3-Methoxy-5-phenethylphenol;3-Methoxy-5-(2-phenylethyl)phenol;3-O-Methyldihydropinosylvin;Dihydropinosylvin monomethyl ether;

Article Data 5

Phenol,3-methoxy-5-(2-phenylethyl)- Specification

The Phenol,3-methoxy-5-(2-phenylethyl)-, with the CAS registry number 17635-59-5, is also known as 3-Hydroxy-5-methoxybibenzyl. This chemical's molecular formula is C15H16O2 and molecular weight is 228.29. What's more, its systematic name is 3-Methoxy-5-(2-phenylethyl)phenol.

Physical properties of Phenol,3-methoxy-5-(2-phenylethyl)- are: (1)ACD/LogP: 4.00; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4; (4)ACD/LogD (pH 7.4): 3.99; (5)ACD/BCF (pH 5.5): 641.19; (6)ACD/BCF (pH 7.4): 637.39; (7)ACD/KOC (pH 5.5): 3554.95; (8)ACD/KOC (pH 7.4): 3533.89; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 18.46 Å2; (13)Index of Refraction: 1.585; (14)Molar Refractivity: 68.84 cm3; (15)Molar Volume: 205.3 cm3; (16)Polarizability: 27.29×10-24 cm3; (17)Surface Tension: 43.5 dyne/cm; (18)Density: 1.111 g/cm3; (19)Flash Point: 194.3 °C; (20)Enthalpy of Vaporization: 63.96 kJ/mol; (21)Boiling Point: 368.7 °C at 760 mmHg; (22)Vapour Pressure: 5.89E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: COC1=CC(=CC(=C1)O)CCC2=CC=CC=C2
(2)InChI: InChI=1S/C15H16O2/c1-17-15-10-13(9-14(16)11-15)8-7-12-5-3-2-4-6-12/h2-6,9-11,16H,7-8H2,1H3
(3)InChIKey: HPEFWCAKFRCLBD-UHFFFAOYSA-N

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