CAS No.30578-37-1,Amezinium methylsulfate Suppliers

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Basic Information

Molecular Structure:
CAS No.:	30578-37-1
Name:	Amezinium methylsulfate
Article Data:	2

Formula:	C₁₁H₁₂N₃O^.CH₃O₄S
Molecular Weight:	313.334
Synonyms:	Amezinium metilsulfate (JAN);Risumic (TN);6-methoxy-1-phenyl-pyridazin-4-amine; sulfonatooxymethane;Pyridazinium,4-amino-6-methoxy-1-phenyl-,methyl sulfate;Regulton;Lu 1631;Risumic;
EINECS:	250-248-0
Melting Point:	176° (dec)
PSA:	126.83000
LogP:	1.70410

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Analytical Methods

4-Chloro-5-amino-2-phenyl-3(2H)-pyridazinone (I) is treated with Pd/C/NaBH4 to give 5-amino-2-phenyl-3(2H)-pyridazinone (II), which is O-methylated with dimethylsultate to LU-1631.

Specification

The Mezinium Methyl Sulfate is an organic compound with the formula C₁₁H₁₂N₃O^.CH₃O₄S. The IUPAC name of this chemical is 6-methoxy-1-phenylpyridazin-1-ium-4-amine; methyl sulfate. With the CAS registry number 30578-37-1, it is also named as 4-Amino-6-methoxy-1-phenylpyridazin-1-ium methyl sulfate. The product's classification codes are Antihypotensive; Drug / Therapeutic Agent; Reproductive Effect.

Physical properties about Mezinium Methyl Sulfate are: (1)#H bond acceptors: 4; (2)#H bond donors: 2; (3)#Freely Rotating Bonds: 3; (4)Polar Surface Area: 29.24 Å².

You can still convert the following datas into molecular structure:
(1)SMILES: [O-]S(=O)(=O)OC.O(c1[n+](ncc(N)c1)c2ccccc2)C
(2)InChI: InChI=1/C11H11N3O.CH4O4S/c1-15-11-7-9(12)8-13-14(11)10-5-3-2-4-6-10;1-5-6(2,3)4/h2-8,12H,1H3;1H3,(H,2,3,4)
(3)InChIKey: ZEASXVYVFFXULL-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C11H11N3O.CH4O4S/c1-15-11-7-9(12)8-13-14(11)10-5-3-2-4-6-10;1-5-6(2,3)4/h2-8,12H,1H3;1H3,(H,2,3,4)
(5)Std. InChIKey: ZEASXVYVFFXULL-UHFFFAOYSA-N