Cas no 2891444-31-6 (2,6-dimethylpiperazine-2,3,5,6-d4)
2891444-31-6 structure
Product Name:2,6-dimethylpiperazine-2,3,5,6-d4
CAS No:2891444-31-6
MF:C6H14N2
MW:118.213407993317
CID:6827653
PubChem ID:172405374
Update Time:2025-02-15
2,6-dimethylpiperazine-2,3,5,6-d4 Chemical and Physical Properties
Names and Identifiers
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- 2891444-31-6
- CS-25932
- 2,6-dimethylpiperazine-2,3,5,6-d4
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- Inchi： 1S/C6H14N2/c1-5-3-7-4-6(2)8-5/h5-8H,3-4H2,1-2H3/i3D,4D,5D,6D
- InChI Key： IFNWESYYDINUHV-LNFUJOGGSA-N
- SMILES： N1C([2H])(C)C([2H])NC([2H])C1([2H])C
Computed Properties
- Exact Mass: 118.140805439Da
- Monoisotopic Mass: 118.140805439Da
- Isotope Atom Count: 4
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 0
- Complexity: 64.9
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 4
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0
- Topological Polar Surface Area: 24.1?2
2,6-dimethylpiperazine-2,3,5,6-d4 Related Literature
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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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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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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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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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