Cas no 105578-66-3 (1,2-Benzenedicarboxylic acid, mono(2-quinolinylmethyl) ester)
105578-66-3 structure
Product Name:1,2-Benzenedicarboxylic acid, mono(2-quinolinylmethyl) ester
CAS No:105578-66-3
MF:C18H12NO4
MW:306.292184829712
CID:97454
PubChem ID:71333614
Update Time:2025-04-18
1,2-Benzenedicarboxylic acid, mono(2-quinolinylmethyl) ester Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Benzenedicarboxylic acid, mono(2-quinolinylmethyl) ester
- 2-(quinolin-2-ylmethoxycarbonyl)benzoate
- DTXSID40761840
- 2-{[(Quinolin-2-yl)methoxy]carbonyl}benzoate
- 105578-66-3
-
- Inchi： 1S/C18H13NO4/c20-17(21)14-6-2-3-7-15(14)18(22)23-11-13-10-9-12-5-1-4-8-16(12)19-13/h1-10H,11H2,(H,20,21)/p-1
- InChI Key： PQCCOKRNOULARW-UHFFFAOYSA-M
- SMILES： O(C(C1C=CC=CC=1C(=O)[O-])=O)CC1=CC=C2C=CC=CC2=N1
Computed Properties
- Exact Mass: 306.07663286g/mol
- Monoisotopic Mass: 306.07663286g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 23
- Rotatable Bond Count: 4
- Complexity: 433
- 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: 3.7
- Topological Polar Surface Area: 79.3?2
1,2-Benzenedicarboxylic acid, mono(2-quinolinylmethyl) ester Related Literature
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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