CAS No.631-59-4,dihydroxyacetaldehyde Suppliers

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Basic Information

Molecular Structure:
CAS No.:	631-59-4
Name:	dihydroxyacetaldehyde
Article Data:	3

Formula:	C₂H₄O₃
Molecular Weight:	76.052
Synonyms:	Glyoxalhydrate (6CI);Ethanedial, hydrate;Ethanedial, monohydrate;Glyoxalmonohydrate;Dihydroxyacetaldehyde;
EINECS:	211-160-8
Density:	1.401 g/cm³
Boiling Point:	176.3 °C at 760 mmHg
Flash Point:	74.8 °C
PSA:	57.53000
LogP:	-1.50400

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Specification

The Acetaldehyde,dihydroxy- (8CI,9CI), with the CAS registry number 631-59-4, is also known as Glyoxalmonohydrate. This chemical's molecular formula is C₂H₄O₃ and molecular weight is 76.05. What's more, its systematic name is Dihydroxyacetaldehyde and its EINECS number is 211-160-8.

Physical properties of Acetaldehyde,dihydroxy- (8CI,9CI) are: (1)ACD/LogP: -1.13; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.13; (4)ACD/LogD (pH 7.4): -1.13; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 5.77; (8)ACD/KOC (pH 7.4): 5.77; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 35.53 Å²; (13)Index of Refraction: 1.448; (14)Molar Refractivity: 14.52 cm³; (15)Molar Volume: 54.2 cm³; (16)Polarizability: 5.76×10^-24cm³; (17)Surface Tension: 60.7 dyne/cm; (18)Density: 1.401 g/cm³; (19)Flash Point: 74.8 °C; (20)Enthalpy of Vaporization: 48.04 kJ/mol; (21)Boiling Point: 176.3 °C at 760 mmHg; (22)Vapour Pressure: 0.336 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=CC(O)O
(2)InChI: InChI=1S/C2H4O3/c3-1-2(4)5/h1-2,4-5H
(3)InChIKey: ROUFUEVOXWOSOA-UHFFFAOYSA-N