Cas no 112698-83-6 (Morpholine, 4-[(2,4,6-trimethylphenyl)sulfonyl]-)
112698-83-6 structure
Product Name:Morpholine, 4-[(2,4,6-trimethylphenyl)sulfonyl]-
CAS No:112698-83-6
MF:C13H19NO3S
MW:269.359862565994
CID:1200723
PubChem ID:767626
Update Time:2025-04-20
Morpholine, 4-[(2,4,6-trimethylphenyl)sulfonyl]- Chemical and Physical Properties
Names and Identifiers
-
- Morpholine, 4-[(2,4,6-trimethylphenyl)sulfonyl]-
- AB00076182-01
- SR-01000398587-1
- Z45515802
- AH-357/03519061
- Cambridge id 5236212
- SR-01000398587
- 112698-83-6
- Oprea1_667813
- 4-(2,4,6-Trimethyl-benzenesulfonyl)-morpholine
- Oprea1_350116
- 4-(mesitylsulfonyl)morpholine
- CBDivE_007702
- 4-(2,4,6-trimethylphenyl)sulfonylmorpholine
- AKOS003620513
-
- Inchi: 1S/C13H19NO3S/c1-10-8-11(2)13(12(3)9-10)18(15,16)14-4-6-17-7-5-14/h8-9H,4-7H2,1-3H3
- InChI Key: QGOLVCFGOQOJAA-UHFFFAOYSA-N
- SMILES: S(C1C(C)=CC(C)=CC=1C)(N1CCOCC1)(=O)=O
Computed Properties
- Exact Mass: 269.10856464g/mol
- Monoisotopic Mass: 269.10856464g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 358
- 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: 1.8
- Topological Polar Surface Area: 55?2
Morpholine, 4-[(2,4,6-trimethylphenyl)sulfonyl]- Related Literature
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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