Name: MORPHOLINOFORMAMIDINE HYDROBROMIDE
SKU: 157415-17-3

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Basic Information

Molecular Structure:
CAS No.:	157415-17-3
Name:	MORPHOLINOFORMAMIDINE HYDROBROMIDE
Article Data:	2

Formula:	C₅H₁₂BrN₃O
Molecular Weight:	210.074
Synonyms:	Morpholine-4-carboxamidine, bromide;
Melting Point:	155-165 °C
Boiling Point:	222.6 °C at 760 mmHg
Flash Point:	88.4 °C
Solubility:	Soluble in water.
Hazard Symbols:	R36/37/38:Irritating to eyes, respiratory system and skin.;
Risk Codes:	36/37/38
Safety:	26-36/37/39
PSA:	62.34000
LogP:	0.90810

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Specification

The 4-Morpholinecarboximidamide,hydrobromide (1:1), with the CAS registry number of 157415-17-3, is also known as Morpholine-4-carboxamidine, bromide. Its molecular formula is C₅H₁₂BrN₃O and molecular weight is 210.07. What's more, its systematic name is Morpholine-4-carboximidamide hydrobromide. In addition, it must be stored in airtight containers and placed in a dry, cool place.

Physical properties about the 4-Morpholinecarboximidamide,hydrobromide (1:1) are: (1)ACD/LogP: -2.29; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 4; (8)#H bond donors: 3; (9)#Freely Rotating Bonds: 0; (10)Polar Surface Area: 28.07 Å²; (11)Flash Point: 88.4 °C; (12)Enthalpy of Vaporization: 45.91 kJ/mol; (13)Boiling Point: 222.6 °C at 760 mmHg; (14)Vapour Pressure: 0.101 mmHg at 25 °C.

Uses: it is used to produce other chemicals. For example, it is used to produce 2-(4-Bromo-phenyl)-4-morpholin-4-yl-[1,3,5]triazine. This reaction needs reagent t-BuOK. Meanwhile, it needs solvent Dioxane. The reaction time is 6 h with reaction temperature of 100 °C. The yield is about 80 %.

The 4-Morpholinecarboximidamide,hydrobromide (1:1) can react with 4-Bromo-N-dimethylaminomethylene-benzamide to get 2-(4-Bromo-phenyl)-4-morpholin-4-yl-[1,3,5]triazine

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

You can still convert the following datas into molecular structure:
(1) SMILES: Br.[N@H]=C(N)N1CCOCC1
(2) InChI: InChI=1/C5H11N3O.BrH/c6-5(7)8-1-3-9-4-2-8;/h1-4H2,(H3,6,7);1H
(3) InChIKey: IOHSDHMCZXCESZ-UHFFFAOYAZ