Cas no 109437-82-3 (Benzoic acid, 2-(benzoylamino)-4-methoxy-)
109437-82-3 structure
Product Name:Benzoic acid, 2-(benzoylamino)-4-methoxy-
CAS No:109437-82-3
MF:C15H13NO4
MW:271.268024206162
CID:1188628
PubChem ID:440258
Update Time:2025-04-20
Benzoic acid, 2-(benzoylamino)-4-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 2-(benzoylamino)-4-methoxy-
- 2-benzamido-4-methoxybenzoic acid
- C04208
- DTXSID40331481
- CHEBI:28609
- SCHEMBL2935687
- 2-(benzoylamino)-4-methoxybenzoic acid
- Q27103793
- N-benzoyl-4-methoxyanthranilic acid
- 109437-82-3
-
- Inchi： 1S/C15H13NO4/c1-20-11-7-8-12(15(18)19)13(9-11)16-14(17)10-5-3-2-4-6-10/h2-9H,1H3,(H,16,17)(H,18,19)
- InChI Key： NZSBJWOTLHVBNU-UHFFFAOYSA-N
- SMILES： O(C)C1C=CC(C(=O)O)=C(C=1)NC(C1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 271.08449
- Monoisotopic Mass: 271.08445790g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 4
- Complexity: 352
- 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: 2.8
- Topological Polar Surface Area: 75.6?2
Experimental Properties
- PSA: 75.63
Benzoic acid, 2-(benzoylamino)-4-methoxy- Related Literature
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
-
Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
-
J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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