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Ethan-1,1,2,2-d4-ol,2-methoxy- (9CI)

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Name

Ethan-1,1,2,2-d4-ol,2-methoxy- (9CI)

EINECS N/A
CAS No. 138667-25-1 Density 0.978 g/cm3
PSA 29.46000 LogP -0.37490
Solubility N/A Melting Point N/A
Formula C3H4D4O2 Boiling Point 124.429 °C at 760 mmHg
Molecular Weight 80.12 Flash Point 46.111 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 138667-25-1 (Ethan-1,1,2,2-d4-ol,2-methoxy- (9CI)) Hazard Symbols N/A
Synonyms

2-Methoxy(2H4)ethanol;

 

Ethan-1,1,2,2-d4-ol,2-methoxy- (9CI) Specification

The CAS registry number of Ethan-1,1,2,2-d4-ol,2-methoxy- (9CI) is 138667-25-1. This chemical is also named as 2-Methoxyethanol-1,1,2,2-d4. In addition, its molecular formula is C3H4D4O2 and molecular weight is 80.12. Its systematic name is called 2-Methoxy(2H4)ethanol.

Physical properties about Ethan-1,1,2,2-d4-ol,2-methoxy- (9CI) are: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 9.974; (4)ACD/KOC (pH 7.4): 9.974; (5)#H bond acceptors: 2; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 3; (8)Index of Refraction: 1.386; (9)Molar Refractivity: 19.228 cm3; (10)Molar Volume: 81.924 cm3; (11)Surface Tension: 27.677 dyne/cm; (12)Density: 0.978 g/cm3; (13)Flash Point: 46.111 °C; (14)Enthalpy of Vaporization: 37.54 kJ/mol; (15)Boiling Point: 124.429 °C at 760 mmHg; (16)Vapour Pressure: 5.975 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: [2H]C([2H])(C([2H])([2H])OC)O
(2)InChI: InChI=1/C3H8O2/c1-5-3-2-4/h4H,2-3H2,1H3/i2D2,3D2
(3)InChIKey: XNWFRZJHXBZDAG-RRVWJQJTEO

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