Cas no 5810-48-0 (2-Morpholinol,4-ethyl-2,3,3,5-tetramethyl-, hydrochloride (1:1))
5810-48-0 structure
Product Name:2-Morpholinol,4-ethyl-2,3,3,5-tetramethyl-, hydrochloride (1:1)
CAS No:5810-48-0
MF:C18H14N2O3S
MW:338.380362987518
CID:385714
PubChem ID:1587173
Update Time:2025-04-19
2-Morpholinol,4-ethyl-2,3,3,5-tetramethyl-, hydrochloride (1:1) Chemical and Physical Properties
Names and Identifiers
-
- 2-Morpholinol,4-ethyl-2,3,3,5-tetramethyl-, hydrochloride (1:1)
- (5E)-5-[(E)-3-(furan-2-yl)prop-2-enylidene]-1-(3-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
- AB00098008-01
- DTXSID00364533
- SR-01000220965-1
- SR-01000220965
- 5810-48-0
- AC1LUPXV
-
- Inchi： 1S/C18H14N2O3S/c1-12-5-2-6-13(11-12)20-17(22)15(16(21)19-18(20)24)9-3-7-14-8-4-10-23-14/h2-11H,1H3,(H,19,21,24)/b7-3+,15-9+
- InChI Key： QQCAGPSNCMURMM-UVDQGBRZSA-N
- SMILES： S=C1NC(/C(=C\C=C\C2=CC=CO2)/C(N1C1C=CC=C(C)C=1)=O)=O
Computed Properties
- Exact Mass: 338.07262
- Monoisotopic Mass: 338.07251349g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 24
- Rotatable Bond Count: 3
- Complexity: 599
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 2
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.4
- Topological Polar Surface Area: 94.6?2
Experimental Properties
- PSA: 62.55
2-Morpholinol,4-ethyl-2,3,3,5-tetramethyl-, hydrochloride (1:1) Related Literature
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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