Cas no 5941-45-7 (2,4,6,8,10,12-Tetradecahexaenedioicacid, diethyl ester, (all-E)- (9CI))
5941-45-7 structure
Product Name:2,4,6,8,10,12-Tetradecahexaenedioicacid, diethyl ester, (all-E)- (9CI)
CAS No:5941-45-7
MF:C19H25NO2
MW:299.40730547905
CID:381554
PubChem ID:1990838
Update Time:2025-04-19
2,4,6,8,10,12-Tetradecahexaenedioicacid, diethyl ester, (all-E)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 2,4,6,8,10,12-Tetradecahexaenedioicacid, diethyl ester, (all-E)- (9CI)
- 2-(3,4-dimethoxyphenyl)-N-[(4-ethylphenyl)methyl]ethanamine
- CHEMBRDG-BB 5941457
- EU-0037961
- 353773-29-2
- AKOS000231981
- CBMicro_037824
- BIM-0038061.P001
- DTXSID30974826
- 2-(3,4-Dimethoxyphenyl)-N-[(4-ethylphenyl)methyl]ethan-1-amine
- 5941-45-7
- 2-(3,4-dimethoxyphenyl)-N-(4-ethylbenzyl)ethanamine
-
- Inchi： 1S/C19H25NO2/c1-4-15-5-7-17(8-6-15)14-20-12-11-16-9-10-18(21-2)19(13-16)22-3/h5-10,13,20H,4,11-12,14H2,1-3H3
- InChI Key： LYMFHONIVZTTIL-UHFFFAOYSA-N
- SMILES： O(C)C1=C(C=CC(=C1)CCNCC1C=CC(CC)=CC=1)OC
Computed Properties
- Exact Mass: 299.188529040g/mol
- Monoisotopic Mass: 299.188529040g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 22
- Rotatable Bond Count: 8
- Complexity: 289
- 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: 3.6
- Topological Polar Surface Area: 30.5?2
2,4,6,8,10,12-Tetradecahexaenedioicacid, diethyl ester, (all-E)- (9CI) Related Literature
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
-
Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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