Cas no 16996-47-7 (1,3-Benzenedicarboxylic acid, bis(4-aminophenyl) ester)
16996-47-7 structure
Product Name:1,3-Benzenedicarboxylic acid, bis(4-aminophenyl) ester
CAS No:16996-47-7
MF:C20H16N2O4
MW:348.352045059204
CID:95671
PubChem ID:59364829
Update Time:2025-04-18
1,3-Benzenedicarboxylic acid, bis(4-aminophenyl) ester Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Benzenedicarboxylic acid, bis(4-aminophenyl) ester
- bis(4-aminophenyl) benzene-1,3-dicarboxylate
- 16996-47-7
- DTXSID50731655
- SCHEMBL8445592
-
- Inchi： 1S/C20H16N2O4/c21-15-4-8-17(9-5-15)25-19(23)13-2-1-3-14(12-13)20(24)26-18-10-6-16(22)7-11-18/h1-12H,21-22H2
- InChI Key： FRCGXWDENTYRDC-UHFFFAOYSA-N
- SMILES： O(C1C=CC(=CC=1)N)C(C1C=CC=C(C(=O)OC2C=CC(=CC=2)N)C=1)=O
Computed Properties
- Exact Mass: 348.11100700g/mol
- Monoisotopic Mass: 348.11100700g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 26
- Rotatable Bond Count: 6
- Complexity: 440
- 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: 3.4
- Topological Polar Surface Area: 105?2
1,3-Benzenedicarboxylic acid, bis(4-aminophenyl) ester Related Literature
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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