Cas no 56048-49-8 ((2S,6S)-2,6-dimethyl-4-tridecylmorpholine)
56048-49-8 structure
Product Name:(2S,6S)-2,6-dimethyl-4-tridecylmorpholine
CAS No:56048-49-8
MF:C19H39NO
MW:297.519066095352
CID:1596201
PubChem ID:12917941
Update Time:2025-04-21
(2S,6S)-2,6-dimethyl-4-tridecylmorpholine Chemical and Physical Properties
Names and Identifiers
-
- (2S,6S)-2,6-dimethyl-4-tridecylmorpholine
- Q27271327
- 2,6-Dimethyl-4-tridecylmorpholine, trans-
- 56048-49-8
- Trans-2,6-dimethyl-4-tridecylmorpholine
- UNII-90I45V3U80
- Morpholine, 2,6-dimethyl-4-tridecyl-, trans-
- 90I45V3U80
-
- Inchi: 1S/C19H39NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-20-16-18(2)21-19(3)17-20/h18-19H,4-17H2,1-3H3/t18-,19-/m1/s1
- InChI Key: YTOPFCCWCSOHFV-RTBURBONSA-N
- SMILES: O1[C@H](C)CN(CCCCCCCCCCCCC)C[C@H]1C
Computed Properties
- Exact Mass: 297.30337
- Monoisotopic Mass: 297.303164868g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 21
- Rotatable Bond Count: 12
- Complexity: 222
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 6.9
- Topological Polar Surface Area: 12.5?2
Experimental Properties
- PSA: 12.47
(2S,6S)-2,6-dimethyl-4-tridecylmorpholine Related Literature
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
-
David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
-
Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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