Cas no 16502-59-3 (3-Thiomorpholinone,2,2-diphenyl-)
16502-59-3 structure
Product Name:3-Thiomorpholinone,2,2-diphenyl-
CAS No:16502-59-3
MF:C16H13NO2S
MW:283.344922780991
CID:161483
PubChem ID:3038066
Update Time:2025-04-19
3-Thiomorpholinone,2,2-diphenyl- Chemical and Physical Properties
Names and Identifiers
-
- 3-Thiomorpholinone,2,2-diphenyl-
- 6,6-diphenyl-5-sulfanylidenemorpholin-3-one
- 2,2-Diphenyl-3-thiomorpholinone
- 3-Thiomorpholinone, 2,2-diphenyl-
- DTXSID70167836
- 16502-59-3
- 2,2-Diphenyl-3-thiomorpholone
- 2,2-Diphenyl-3-thiomorpholone [French]
-
- Inchi： 1S/C16H13NO2S/c18-14-11-19-16(15(20)17-14,12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10H,11H2,(H,17,18,20)
- InChI Key： IHOJXQMMANARFO-UHFFFAOYSA-N
- SMILES： S=C1C(C2C=CC=CC=2)(C2C=CC=CC=2)OCC(N1)=O
Computed Properties
- Exact Mass: 283.06679
- Monoisotopic Mass: 283.067
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 366
- 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: 2.8
- Topological Polar Surface Area: 70.4?2
Experimental Properties
- Density: 1.32
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- Refractive Index: 1.678
- PSA: 38.33
3-Thiomorpholinone,2,2-diphenyl- Related Literature
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
-
Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
-
Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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