Phenol,2-[[bis(2-hydroxyethyl)amino]methyl]- (51527-96-9)

The CAS register number of 2-[[Bis(2-hydroxyethyl)amino]methyl]phenol is 51527-96-9. It also can be called as [Bis(2-hydroxyethyl)amino]-o-cresol and the IUPAC name about this chemical is 2-[[bis(2-hydroxyethyl)amino]methyl]phenol. The molecular formula about this chemical is C₁₁H₁₇NO₃ and molecular weight is 211.26.

Physical properties about 2-[[Bis(2-hydroxyethyl)amino]methyl]phenol are: (1)ACD/LogP: 0.74; (2)ACD/LogD (pH 5.5): -0.87; (3)ACD/LogD (pH 7.4): 0.56; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1.41; (6)ACD/KOC (pH 5.5): 1.49; (7)ACD/KOC (pH 7.4): 39.47; (8)#H bond acceptors: 4; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 9; (11)Polar Surface Area: 30.93Ų; (12)Index of Refraction: 1.592; (13)Molar Refractivity: 58.37 cm³; (14)Molar Volume: 172.4 cm³; (15)Polarizability: 23.14x10^-24cm³; (16)Surface Tension: 58.7 dyne/cm; (17)Enthalpy of Vaporization: 68.41 kJ/mol; (18)Boiling Point: 398.2 °C at 760 mmHg; (19)Vapour Pressure: 4.69E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Oc1ccccc1CN(CCO)CCO
(2)InChI: InChI=1/C11H17NO3/c13-7-5-12(6-8-14)9-10-3-1-2-4-11(10)15/h1-4,13-15H,5-9H2
(3)InChIKey: HELHBQQQHPNNME-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C11H17NO3/c13-7-5-12(6-8-14)9-10-3-1-2-4-11(10)15/h1-4,13-15H,5-9H2
(5)Std. InChIKey: HELHBQQQHPNNME-UHFFFAOYSA-N