4-[4-[(5S)-5-(Aminomethyl)-2-oxo-3-oxazolidinyl]phenyl]-3-morpholinone hydrochloride CAS NO.898543-06-1

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 The 4-[4-[(5S)-5-(Aminomethyl)-2-oxo-3-oxazolidinyl]phenyl]-3-morpholinone hydrochloride, with the CAS registry number 898543-06-1, is also known as (S)-4-(4-(5-(Aminomethyl)-2-oxooxazolidin-3-yl)phenyl)morpholin-3-one hydrochloride. It belongs to the product category of Intermediates. This chemical's molecular formula is C₁₄H₁₇N₃O₄^.HCl and molecular weight is 327.77. What's more, its systematic name is 4-{4-[(5S)-5-(Aminomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl}-3-morpholinone hydrochloride (1:1).

Physical properties of 4-[4-[(5S)-5-(Aminomethyl)-2-oxo-3-oxazolidinyl]phenyl]-3-morpholinone hydrochloride are: (1)ACD/BCF (pH 5.5): 1.00; (2)ACD/BCF (pH 7.4): 1.00; (3)ACD/KOC (pH 5.5): 1.00; (4)ACD/KOC (pH 7.4): 1.00; (5)#H bond acceptors: 7; (6)#H bond donors: 2; (7)#Freely Rotating Bonds: 4; (8)Polar Surface Area: 62.32 Å²; (9)Flash Point: 313 °C; (10)Enthalpy of Vaporization: 90.17 kJ/mol; (11)Boiling Point: 593.9 °C at 760 mmHg; (12)Vapour Pressure: 2.18E-14 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cl.O=C1O[C@@H](CN)CN1c3ccc(N2C(=O)COCC2)cc3
(2)Std. InChI: InChI=1S/C14H17N3O4.ClH/c15-7-12-8-17(14(19)21-12)11-3-1-10(2-4-11)16-5-6-20-9-13(16)18;/h1-4,12H,5-9,15H2;1H/t12-;/m0./s1
(3)Std. InChIKey: ITMQDYQHNKXERQ-YDALLXLXSA-N