Molecular Structure of 3-(2-Hydroxy-2-propyl)phenol (CAS NO.7765-97-1):
Systematic Name: 3-(2-Hydroxypropan-2-yl)phenol
Molecular Formula: C9H12O2
Molecular Weight: 152.19
Mol File: 7765-97-1.mol
H bond acceptors: 2
H bond donors: 2
Freely Rotating Bonds: 3
Index of Refraction: 1.553
Molar Refractivity: 43.42 cm3
Molar Volume: 135.5 cm3
Surface Tension: 43 dyne/cm
Density: 1.122 g/cm3
Flash Point: 140 °C
Enthalpy of Vaporization: 55.7 kJ/mol
Boiling Point: 288.2 °C at 760 mmHg
Vapour Pressure: 0.0011 mmHg at 25 °C
SMILES: OC(c1cc(O)ccc1)(C)C
InChI: InChI=1/C9H12O2/c1-9(2,11)7-4-3-5-8(10)6-7/h3-6,10-11H,1-2H3
InChIKey: KNCICOZTHWGRMY-UHFFFAOYAG
3-(2-Hydroxy-2-propyl)phenol (CAS NO.7765-97-1), its Synonyms are m-Hydroxycumyl alcohol ; Benzenemethanol,3-hydroxy-a,a-dimethyl- ; Benzylalcohol, m-hydroxy-a,a-dimethyl- (6CI,7CI,8CI) ; m-(1-Hydroxy-1-methylethyl)phenol .
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