4-Morpholineaceticacid, 2,6-dioxo- supplier

Name
2,6-dioxo-N-(carboxymethyl)morpholine
EINECS
CAS No. 33658-49-0
Article Data8
CAS DataBase
Density 1.521 g/cm³
Solubility
Melting Point
Formula C₆H₇NO₅
Boiling Point 427.9 °C at 760 mmHg
Molecular Weight 173.125
Flash Point 212.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (2,6-Dioxomorpholin-4-yl)acetic acid;
PSA 83.91000
LogP -1.60570

4-Morpholineaceticacid, 2,6-dioxo- Specification

The 4-Morpholineaceticacid, 2,6-dioxo-, with the CAS registry number of 33658-49-0, is also known as (2,6-Dioxomorpholin-4-yl)acetic acid. Its molecular formula is C₆H₇NO₅ and molecular weight is 173.123480. What's more, its IUPAC name is 2-(2,6-Dioxomorpholin-4-yl)acetic acid.

Physical properties about the 4-Morpholineaceticacid, 2,6-dioxo- are: (1)ACD/LogP: -1.39; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.5; (4)ACD/LogD (pH 7.4): -4.95; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 6; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 72.91 Å²; (13)Index of Refraction: 1.523; (14)Molar Refractivity: 34.77 cm³; (15)Molar Volume: 113.7 cm³; (16)Surface Tension: 62.5 dyne/cm; (17)Density: 1.521 g/cm³; (18)Flash Point: 212.6 °C; (19)Enthalpy of Vaporization: 74.9 kJ/mol; (20)Boiling Point: 427.9 °C at 760 mmHg; (21)Vapour Pressure: 1.61E-08 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C1OC(=O)CN(CC(=O)O)C1
(2) InChI: InChI=1/C6H7NO5/c8-4(9)1-7-2-5(10)12-6(11)3-7/h1-3H2,(H,8,9)
(3) InChIKey: FHSPYXCBYKGRQZ-UHFFFAOYAS

Product Name

2,6-dioxo-N-(carboxymethyl)morpholine

4-Morpholineaceticacid, 2,6-dioxo- Specification

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