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4-Morpholineacetaldehyde

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Name

4-Morpholineacetaldehyde

EINECS N/A
CAS No. 21977-09-3 Density 1.046 g/cm3
PSA 29.54000 LogP -0.54460
Solubility N/A Melting Point N/A
Formula C6H11NO2 Boiling Point 308.4 °C at 760 mmHg
Molecular Weight 129.159 Flash Point 140.3 °C
Transport Information N/A Appearance N/A
Safety 36/37 Risk Codes 43
Molecular Structure Molecular Structure of 21977-09-3 (MORPHOLIN-4-YL-ACETALDEHYDE MONOHYDRATE HYDROCHLORIDE) Hazard Symbols N/A
Synonyms

2-Morpholinoacetaldehyde;

Article Data 8

4-Morpholineacetaldehyde Specification

The 4-Morpholineacetaldehyde, with the CAS registry number of 21977-09-3, is also known as 2-Morpholinoacetaldehyde. This chemical's molecular formula is C6H11NO2 and molecular weight is 129.16. What's more, its systematic name is Morpholin-4-ylacetaldehyde.

Physical properties about the 4-Morpholineacetaldehyde are: (1)ACD/LogP: -0.23; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.55; (4)ACD/LogD (pH 7.4): -0.23; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 8.59; (8)ACD/KOC (pH 7.4): 17.72; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 29.54 Å2; (13)Index of Refraction: 1.449; (14)Molar Refractivity: 33.13 cm3; (15)Molar Volume: 123.4 cm3; (16)Surface Tension: 33.1 dyne/cm; (17)Density: 1.046 g/cm3; (18)Flash Point: 65.4 °C; (19)Enthalpy of Vaporization: 42.08 kJ/mol; (20)Boiling Point: 184.6 °C at 760 mmHg; (21)Vapour Pressure: 0.729 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=CCN1CCOCC1
(2) InChI: InChI=1/C6H11NO2/c8-4-1-7-2-5-9-6-3-7/h4H,1-3,5-6H2
(3) InChIKey: KKOPYUKQPCQGEM-UHFFFAOYAX

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