Cas no 820238-86-6 (Benzaldehyde, 3-methyl-2-[2-(4-morpholinyl)ethoxy]-4-propoxy-)
820238-86-6 structure
Product Name:Benzaldehyde, 3-methyl-2-[2-(4-morpholinyl)ethoxy]-4-propoxy-
CAS No:820238-86-6
MF:C17H25NO4
MW:307.384705305099
CID:700516
PubChem ID:71420401
Update Time:2025-04-19
Benzaldehyde, 3-methyl-2-[2-(4-morpholinyl)ethoxy]-4-propoxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzaldehyde, 3-methyl-2-[2-(4-morpholinyl)ethoxy]-4-propoxy-
- 3-methyl-2-(2-morpholin-4-ylethoxy)-4-propoxybenzaldehyde
- 3-Methyl-2-[2-(morpholin-4-yl)ethoxy]-4-propoxybenzaldehyde
- DTXSID40839593
- 820238-86-6
- SCHEMBL5444767
-
- Inchi: 1S/C17H25NO4/c1-3-9-21-16-5-4-15(13-19)17(14(16)2)22-12-8-18-6-10-20-11-7-18/h4-5,13H,3,6-12H2,1-2H3
- InChI Key: MKUWCHDOKYKASQ-UHFFFAOYSA-N
- SMILES: O1CCN(CCOC2C(C=O)=CC=C(C=2C)OCCC)CC1
Computed Properties
- Exact Mass: 307.17835828g/mol
- Monoisotopic Mass: 307.17835828g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 22
- Rotatable Bond Count: 8
- Complexity: 320
- 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: 2.2
- Topological Polar Surface Area: 48?2
Benzaldehyde, 3-methyl-2-[2-(4-morpholinyl)ethoxy]-4-propoxy- Related Literature
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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