Cas no 1170802-63-7 (3-[(2-Methylphenyl)methyl]piperidine;hydrochloride)
![3-[(2-Methylphenyl)methyl]piperidine;hydrochloride structure](https://ossimg.kuujia.com/scimg/1171000/1170802-63-7x500.png)
1170802-63-7 structure
Product Name:3-[(2-Methylphenyl)methyl]piperidine;hydrochloride
CAS No:1170802-63-7
MF:C13H20ClN
MW:225.75760269165
CID:2615102
Update Time:2023-08-06
3-[(2-Methylphenyl)methyl]piperidine;hydrochloride Chemical and Physical Properties
Names and Identifiers
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- 3-[(2-methylphenyl)methyl]piperidine,hydrochloride
- 3-[(2-Methylphenyl)methyl]piperidine--hydrogen chloride (1/1)
- 3-[(2-Methylphenyl)methyl]piperidine;hydrochloride
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- Inchi： 1S/C13H19N.ClH/c1-11-5-2-3-7-13(11)9-12-6-4-8-14-10-12;/h2-3,5,7,12,14H,4,6,8-10H2,1H3;1H
- InChI Key： MZRKUQSTSWILPO-UHFFFAOYSA-N
- SMILES： Cl.N1CCCC(CC2C=CC=CC=2C)C1
Computed Properties
- Exact Mass: 225.128
- Monoisotopic Mass: 225.128
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 167
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 12
3-[(2-Methylphenyl)methyl]piperidine;hydrochloride Related Literature
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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5. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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