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1-(2,5-Dimethoxyphenyl)propan-2-ol

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Name

1-(2,5-Dimethoxyphenyl)propan-2-ol

EINECS N/A
CAS No. 40180-96-9 Density 1.062 g/cm3
PSA N/A LogP N/A
Solubility N/A Melting Point N/A
Formula C11H16O3 Boiling Point 304.9 °C at 760mmHg
Molecular Weight 196.246 Flash Point 138.2 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 40180-96-9 (1-(2,5-Dimethoxyphenyl)propan-2-ol) Hazard Symbols N/A
Synonyms

Phenethyl alcohol, 2,5-dimethoxy-alpha-methyl-

Article Data 9

1-(2,5-Dimethoxyphenyl)propan-2-ol Specification

The IUPAC name of this chemical is 1-(2,5-Dimethoxyphenyl)propan-2-ol. With the CAS registry number of 40180-96-9, it is also called Phenethyl alcohol, 2,5-dimethoxy-α-methyl-. In addition, the formula is C11H16O and the molecular weight is 196.2429. 

Physical properties about 1-(2,5-Dimethoxyphenyl)propan-2-ol are: (1)ACD/LogP: 1.59; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 27.69 Å2; (7)Index of Refraction: 1.51; (8)Molar Refractivity: 55.28 cm3; (9)Molar Volume: 184.6 cm3; (10)Polarizability: 21.91×10-24 cm3; (11)Surface Tension: 35.6 dyne/cm; (12)Density: 1.062 g/cm3; (13)Flash Point: 138.2 °C; (14)Enthalpy of Vaporization: 57.58 kJ/mol; (15)Boiling Point: 304.9 °C at 760 mmHg; (16)Vapour Pressure: 0.000373 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES:O(c1ccc(OC)cc1CC(O)C)C
(2)InChI:InChI=1/C11H16O3/c1-8(12)6-9-7-10(13-2)4-5-11(9)14-3/h4-5,7-8,12H,6H2,1-3H3
(3)InChIKey:RPYWIZDAMGNPJB-UHFFFAOYAP
(4)Std. InChI:InChI=1S/C11H16O3/c1-8(12)6-9-7-10(13-2)4-5-11(9)14-3/h4-5,7-8,12H,6H2,1-3H3
(5)Std. InChIKey:RPYWIZDAMGNPJB-UHFFFAOYSA-N

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