Cas no 5419-18-1 (4-hexadecylmorpholine)
4-hexadecylmorpholine structure
Product Name:4-hexadecylmorpholine
CAS No:5419-18-1
MF:C20H41NO
MW:311.545646429062
CID:940030
PubChem ID:117615
Update Time:2025-04-19
4-hexadecylmorpholine Chemical and Physical Properties
Names and Identifiers
-
- 4-hexadecylmorpholine
- AI3-19525
- NSC9653
- NS00027951
- cetylmorpholine
- NSC-9653
- NSC9652
- AKOS024390916
- 25727-91-7
- AS-57443
- N-CETYLMORPHOLINE
- DTXSID5067130
- Morpholine, 4-hexadecyl-
- JCTYXESWNZITDY-UHFFFAOYSA-N
- 5419-18-1
- NSC-9652
- SCHEMBL1261601
- EINECS 247-212-1
-
- Inchi： 1S/C20H41NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-17-19-22-20-18-21/h2-20H2,1H3
- InChI Key： JCTYXESWNZITDY-UHFFFAOYSA-N
- SMILES： O1CCN(CC1)CCCCCCCCCCCCCCCC
Computed Properties
- Exact Mass: 577.48384
- Monoisotopic Mass: 311.319
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 22
- Rotatable Bond Count: 15
- Complexity: 214
- 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
- Topological Polar Surface Area: 12.5A^2
- XLogP3: 7.6
Experimental Properties
- Density: 0.872
- Boiling Point: 396°C at 760 mmHg
- Flash Point: 116.5°C
- Refractive Index: 1.459
- PSA: 79.23
- LogP: 5.73780
4-hexadecylmorpholine Related Literature
-
Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
-
Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
-
Jason Wan Lab Chip, 2020,20, 4528-4538
-
Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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