Cas no 62718-29-0 (4-Piperidinecarbonitrile, 1,4-dimethyl-)
62718-29-0 structure
Product Name:4-Piperidinecarbonitrile, 1,4-dimethyl-
CAS No:62718-29-0
MF:C8H14N2
MW:138.210161685944
CID:434247
PubChem ID:18711371
Update Time:2025-04-19
4-Piperidinecarbonitrile, 1,4-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 4-Piperidinecarbonitrile, 1,4-dimethyl-
- 1,4-dimethylpiperidine-4-carbonitrile
- DTXSID40595768
- SCHEMBL8257793
- 62718-29-0
-
- Inchi： 1S/C8H14N2/c1-8(7-9)3-5-10(2)6-4-8/h3-6H2,1-2H3
- InChI Key： QTWQALQTWXMGDT-UHFFFAOYSA-N
- SMILES： N1(C)CCC(C#N)(C)CC1
Computed Properties
- Exact Mass: 138.11582
- Monoisotopic Mass: 138.115698455g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 157
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.8
- Topological Polar Surface Area: 27?2
Experimental Properties
- PSA: 27.03
4-Piperidinecarbonitrile, 1,4-dimethyl- Related Literature
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
62718-29-0 (4-Piperidinecarbonitrile, 1,4-dimethyl-) Related Products
- 164926-88-9(2-(1-methyl-4-piperidyl)acetonitrile)
- 4395-98-6(Piperidine-4-carbonitrile)
- 4606-63-7(1-methylpiperidine-3-carbonitrile)
- 20691-92-3(1-methylpiperidine-4-carbonitrile)
- 51627-76-0(1-Azabicyclo[2.2.2]octane-3-carbonitrile)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
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