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CAS No.: | 85275-44-1 |
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Name: | (S)-1-BOC-3-HYDROXYPIPERIDINE |
Molecular Structure: | |
Formula: | C21H22N2S.HCl |
Molecular Weight: | 370.94 |
Synonyms: | 2-[(1-Methyl-3-piperidinyl)thio]-3-phenylquinoline hydrochloride |
PSA: | 41.43000 |
LogP: | 5.82800 |
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The CAS register number of 2-[(1-Methyl-3-piperidinyl)thio]-3-phenylquinoline hydrochloride is 85275-44-1. The systematic name about this chemical is quinoline, 2-[(1-methyl-3-piperidinyl)thio]-3-phenyl-, hydrochloride (1:1). The molecular formula about this chemical is C21H22N2S.HCl and molecular weight is 370.94.
You can still convert the following datas into molecular structure:
(1)SMILES: CN1CCCC(C1)Sc2c(cc3ccccc3n2)c4ccccc4.Cl
(2)InChI: InChI=1/C21H22N2S.ClH/c1-23-13-7-11-18(15-23)24-21-19(16-8-3-2-4-9-16)14-17-10-5-6-12-20(17)22-21;/h2-6,8-10,12,14,18H,7,11,13,15H2,1H3;1H
(3)InChIKey: ZRWQRFPKDJWRHP-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C21H22N2S.ClH/c1-23-13-7-11-18(15-23)24-21-19(16-8-3-2-4-9-16)14-17-10-5-6-12-20(17)22-21;/h2-6,8-10,12,14,18H,7,11,13,15H2,1H3;1H
(5)Std. InChIKey: ZRWQRFPKDJWRHP-UHFFFAOYSA-N