Cas no 1261910-17-1 (4-(4-Carboxyphenyl)nicotinic acid)
1261910-17-1 structure
Product Name:4-(4-Carboxyphenyl)nicotinic acid
CAS No:1261910-17-1
MF:C13H9NO4
MW:243.214863538742
CID:2762869
PubChem ID:53229317
Update Time:2025-04-21
4-(4-Carboxyphenyl)nicotinic acid Chemical and Physical Properties
Names and Identifiers
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- MFCD18323475
- 4-(4-Carboxyphenyl)nicotinic acid, 95%
- 1261910-17-1
- DTXSID80692543
- 4-(4-CARBOXYPHENYL)NICOTINIC ACID
- 4-(4-Carboxyphenyl)nicotinic acid
-
- Inchi： 1S/C13H9NO4/c15-12(16)9-3-1-8(2-4-9)10-5-6-14-7-11(10)13(17)18/h1-7H,(H,15,16)(H,17,18)
- InChI Key： KRITYLOQFSMJPG-UHFFFAOYSA-N
- SMILES： OC(C1C=NC=CC=1C1C=CC(C(=O)O)=CC=1)=O
Computed Properties
- Exact Mass: 243.05315777Da
- Monoisotopic Mass: 243.05315777Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 18
- Rotatable Bond Count: 3
- Complexity: 323
- 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: 1.5
- Topological Polar Surface Area: 87.5?2
4-(4-Carboxyphenyl)nicotinic acid Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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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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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
1261910-17-1 (4-(4-Carboxyphenyl)nicotinic acid) Related Products
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