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CAS No.: | 13127-28-1 |
---|---|
Name: | N-Benzyl-N-methylpiperidinium chloride |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C13H20N.Cl |
Molecular Weight: | 225.762 |
Synonyms: | 1-Benzyl-1-methylpiperidiniumchloride (7CI);Piperidinium, 1-benzyl-1-methyl-, chloride (8CI);Piperidinium,1-methyl-1-(phenylmethyl)-, chloride (9CI);N-Benzyl-N-methylpiperidiniumchloride; |
PSA: | 0.00000 |
LogP: | -0.22010 |
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The N-Benzyl-N-methylpiperidinium chloride, with the CAS registry number 13127-28-1, is also known as Piperidinium, 1-methyl-1-(phenylmethyl)-, chloride (1:1). This chemical's molecular formula is C13H20N.Cl and molecular weight is 225.76. Its systematic name is called 1-benzyl-1-methylpiperidinium chloride.
You can still convert the following datas into molecular structure of N-Benzyl-N-methylpiperidinium chloride:
(1)SMILES: [Cl-].C[N+]2(Cc1ccccc1)CCCCC2
(2)InChI: InChI=1/C13H20N.ClH/c1-14(10-6-3-7-11-14)12-13-8-4-2-5-9-13;/h2,4-5,8-9H,3,6-7,10-12H2,1H3;1H/q+1;/p-1
(3)InChIKey: GKYHYQLPNLSRKB-REWHXWOFAQ
(4)Std. InChI: InChI=1S/C13H20N.ClH/c1-14(10-6-3-7-11-14)12-13-8-4-2-5-9-13;/h2,4-5,8-9H,3,6-7,10-12H2,1H3;1H/q+1;/p-1
(5)Std. InChIKey: GKYHYQLPNLSRKB-UHFFFAOYSA-M