The 4-Piperidineaceticacid, 1-methyl-, hydrochloride (1:1), with the CAS registry number 67686-06-0, is also known as (1-Methylpiperidin-4-yl)acetic acid hydrochloride (1:1). This chemical's molecular formula is C8H15NO2·ClH and formula weight is 193.67. What's more, its IUPAC name is 2-(1-methylpiperidin-4-yl)acetic acid hydrochloride.
Physical properties of 4-Piperidineaceticacid, 1-methyl-, hydrochloride (1:1) are: (1)#H bond acceptors: 3; (2)#H bond donors: 2; (3)Rotatable Bond Count: 2; (4)Exact Mass: 193.086956; (5)MonoIsotopic Mass: 193.086956; (6) Polar Surface Area: 40.5 Å2; (7)Heavy Atom Count: 12; (8)Complexity: 139; (9)Covalently-Bonded Unit Count: 2.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CN1CCC(CC1)CC(=O)O.Cl
(2)InChI: InChI=1S/C8H15NO2.ClH/c1-9-4-2-7(3-5-9)6-8(10)11;/h7H,2-6H2,1H3,(H,10,11);1H
(3)InChIKey: IWTQIIYMXVDTNH-UHFFFAOYSA-N
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