Cas no 663625-66-9 (Benzoic acid, 3-amino-4-[2-(2-aminophenoxy)ethoxy]-)
![Benzoic acid, 3-amino-4-[2-(2-aminophenoxy)ethoxy]- structure](https://ossimg.kuujia.com/scimg/664000/663625-66-9x500.png)
663625-66-9 structure
Product Name:Benzoic acid, 3-amino-4-[2-(2-aminophenoxy)ethoxy]-
CAS No:663625-66-9
MF:C15H16N2O4
MW:288.298543930054
CID:396410
PubChem ID:71375073
Update Time:2025-04-19
Benzoic acid, 3-amino-4-[2-(2-aminophenoxy)ethoxy]- Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid, 3-amino-4-[2-(2-aminophenoxy)ethoxy]-
- 3-amino-4-[2-(2-aminophenoxy)ethoxy]benzoic acid
- 663625-66-9
- DTXSID40797826
-
- Inchi： 1S/C15H16N2O4/c16-11-3-1-2-4-13(11)20-7-8-21-14-6-5-10(15(18)19)9-12(14)17/h1-6,9H,7-8,16-17H2,(H,18,19)
- InChI Key： BKTJGMLEZJVSIH-UHFFFAOYSA-N
- SMILES： O(C1C=CC(C(=O)O)=CC=1N)CCOC1C=CC=CC=1N
Computed Properties
- Exact Mass: 288.11108
- Monoisotopic Mass: 288.11100700g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 21
- Rotatable Bond Count: 6
- Complexity: 340
- 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: 1.7
- Topological Polar Surface Area: 108?2
Experimental Properties
- PSA: 107.8
Benzoic acid, 3-amino-4-[2-(2-aminophenoxy)ethoxy]- Related Literature
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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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
663625-66-9 (Benzoic acid, 3-amino-4-[2-(2-aminophenoxy)ethoxy]-) Related Products
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