Cas no 88194-14-3 (1,3-Benzenedicarboxylic acid, 5-[(1-oxopropyl)amino]-)
88194-14-3 structure
Product Name:1,3-Benzenedicarboxylic acid, 5-[(1-oxopropyl)amino]-
CAS No:88194-14-3
MF:C11H11NO5
MW:237.208743333817
CID:641519
PubChem ID:24284469
Update Time:2025-04-19
1,3-Benzenedicarboxylic acid, 5-[(1-oxopropyl)amino]- Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Benzenedicarboxylic acid, 5-[(1-oxopropyl)amino]-
- 5-(propanoylamino)benzene-1,3-dicarboxylic acid
- 88194-14-3
- 5-Propanamidobenzene-1,3-dicarboxylic acid
- AKOS008985210
- DTXSID30640675
-
- Inchi: 1S/C11H11NO5/c1-2-9(13)12-8-4-6(10(14)15)3-7(5-8)11(16)17/h3-5H,2H2,1H3,(H,12,13)(H,14,15)(H,16,17)
- InChI Key: IPUXWGIQEZKLJO-UHFFFAOYSA-N
- SMILES: O=C(CC)NC1C=C(C(=O)O)C=C(C(=O)O)C=1
Computed Properties
- Exact Mass: 237.06372245g/mol
- Monoisotopic Mass: 237.06372245g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 17
- Rotatable Bond Count: 4
- Complexity: 306
- 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: 0.6
- Topological Polar Surface Area: 104?2
1,3-Benzenedicarboxylic acid, 5-[(1-oxopropyl)amino]- Related Literature
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
88194-14-3 (1,3-Benzenedicarboxylic acid, 5-[(1-oxopropyl)amino]-) Related Products
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- 556-08-1(4-Acetamidobenzoic acid)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
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