3-(1-(Dimethylamino)ethyl]phenol supplier

Name
3-(1-(Dimethylamino)ethyl]phenol
EINECS 600-665-2
CAS No. 105601-04-5
Article Data15
CAS DataBase
Density 1.021 g/cm³
Solubility
Melting Point 87-89°C
Formula C₁₀H₁₅NO
Boiling Point 241.3 °C at 760 mmHg
Molecular Weight 165.235
Flash Point 97.2 °C
Transport Information
Appearance pale brown solid
Safety 26-39-45
Risk Codes 25-41
Molecular Structure
Hazard Symbols T
Synonyms ZNS 114-666;
PSA 23.47000
LogP 2.01480

3-(1-(Dimethylamino)ethyl]phenol Specification

The 3-(1-(Dimethylamino)ethyl]phenol is an organic compound with the formula C₁₀H₁₅NO. The IUPAC name of this chemical is 3-[(1R)-1-(dimethylamino)ethyl]phenol. With the CAS registry number 105601-04-5, it is also named as Phenol, 3-[1-(dimethylamino)ethyl]-. The product's categories are Amines; Aromatics; Intermediates & Fine Chemicals; Metabolites & Impurities; Pharmaceuticals. Besides, it is a pale brown solid, which is used as an major metabolite of rivastigmine.

Physical properties about 3-(1-(Dimethylamino)ethyl]phenol are: (1)ACD/LogP: 1.59; (2)#H bond acceptors: 2; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 3; (5)Polar Surface Area: 12.47 Å²; (6)Index of Refraction: 1.539; (7)Molar Refractivity: 50.67 cm³; (8)Molar Volume: 161.6 cm³; (9)Polarizability: 20.08×10^-24cm³; (10)Surface Tension: 38.5 dyne/cm; (11)Density: 1.021 g/cm³; (12)Flash Point: 97.2 °C; (13)Enthalpy of Vaporization: 49.77 kJ/mol; (14)Boiling Point: 241.3 °C at 760 mmHg; (15)Vapour Pressure: 0.0233 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Oc1cc(ccc1)C(N(C)C)C
(2)InChI: InChI=1/C10H15NO/c1-8(11(2)3)9-5-4-6-10(12)7-9/h4-8,12H,1-3H3
(3)InChIKey: GQZXRLWUYONVCP-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C10H15NO/c1-8(11(2)3)9-5-4-6-10(12)7-9/h4-8,12H,1-3H3
(5)Std. InChIKey: GQZXRLWUYONVCP-UHFFFAOYSA-N

Product Name

3-(1-(Dimethylamino)ethyl]phenol

3-(1-(Dimethylamino)ethyl]phenol Specification

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