Cas no 2891444-64-5 (3,5-dimethylmorpholine-2,2,3,5,6,6-d6)
2891444-64-5 structure
Product Name:3,5-dimethylmorpholine-2,2,3,5,6,6-d6
CAS No:2891444-64-5
MF:C6H13NO
MW:121.210491895676
CID:6827671
PubChem ID:172406958
Update Time:2025-02-15
3,5-dimethylmorpholine-2,2,3,5,6,6-d6 Chemical and Physical Properties
Names and Identifiers
-
- CS-25950
- 3,5-dimethylmorpholine-2,2,3,5,6,6-d6
- 2891444-64-5
-
- Inchi： 1S/C6H13NO/c1-5-3-8-4-6(2)7-5/h5-7H,3-4H2,1-2H3/i3D2,4D2,5D,6D
- InChI Key： MDKHWJFKHDRFFZ-VYXNDPKGSA-N
- SMILES： O1C([2H])([2H])C([2H])(C)NC([2H])(C)C1([2H])[2H]
Computed Properties
- Exact Mass: 121.137374514Da
- Monoisotopic Mass: 121.137374514Da
- Isotope Atom Count: 6
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 0
- Complexity: 66.9
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.3
- Topological Polar Surface Area: 21.3?2
3,5-dimethylmorpholine-2,2,3,5,6,6-d6 Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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