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Moroxydine

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Name

Moroxydine

EINECS 223-093-1
CAS No. 3731-59-7 Density 1.51 g/cm3
PSA 98.22000 LogP -0.03500
Solubility N/A Melting Point 211-214 °C(lit.)
Formula C6H13N5O Boiling Point 327 °C at 760 mmHg
Molecular Weight 171.202 Flash Point 151.6 °C
Transport Information N/A Appearance WHITE TO OFF-WHITE POWDER, CRYSTALS,. CRYSTALLINE POWDER AND/OR CHUNKS
Safety 26-37/39-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 3731-59-7 (Moroxydine) Hazard Symbols IrritantXi
Synonyms

4-Morpholinecarboxamidine,N-amidino- (8CI);Guanidine, 4-morpholinecarboximidoyl- (6CI);4-Morpholinecarboximidoylguanidine;ABOB;JD 1022;Moroxydine;N1,N1-Anhydrobis(b-hydroxyethyl)biguanide;SKF 8898A;Vironil;Virugon;Virumin;Wirumin;

Article Data 13

Moroxydine Specification

The CAS register number of Moroxydine is 3731-59-7. It also can be called as 4-Morpholinecarboximidoylguanidine and the systematic name about this chemical is N-(diaminomethylidene)morpholine-4-carboximidamide. Its molecular formula is C6H13N5O and molecular weight is 171.2.

Physical properties about Moroxydine are: (1)ACD/LogP: -2.60; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -4.6; (4)ACD/LogD (pH 7.4): -4.5; (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: 5; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 43.67Å2; (13)Index of Refraction: 1.661; (14)Molar Refractivity: 41.78 cm3; (15)Molar Volume: 112.9 cm3; (16)Surface Tension: 69.2 dyne/cm; (17)Density: 1.51 g/cm3; (18)Flash Point: 151.6 °C; (19)Enthalpy of Vaporization: 56.93 kJ/mol; (20)Boiling Point: 327 °C at 760 mmHg; (21)Vapour Pressure: 0.000207 mmHg at 25°C.

Uses of Moroxydine: It reacts with imidazo[1,2-a]pyridine-2-carboxylic acid ethyl ester to get 4-imidazo[1,2-a]pyridin-2-yl-6-morpholin-4-yl-[1,3,5]triazin-2-ylamine. This reaction needs solvent methanol. The yield is 30 %.



When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. People must wear suitable protective clothing, gloves and eye/face protection. 

People can use the following data to convert to the molecule structure.
1.SMILES: N(=C(\N)N)\C(=[N@H])N1CCOCC1
2.InChI: InChI=1/C6H13N5O/c7-5(8)10-6(9)11-1-3-12-4-2-11/h1-4H2,(H5,7,8,9,10)
3.InChIKey: KJHOZAZQWVKILO-UHFFFAOYAH
4.Std. InChI: InChI=1S/C6H13N5O/c7-5(8)10-6(9)11-1-3-12-4-2-11/h1-4H2,(H5,7,8,9,10)

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