Cas no 195375-38-3 (4-Pyridinepropanoic acid, acetate)
195375-38-3 structure
Product Name:4-Pyridinepropanoic acid, acetate
CAS No:195375-38-3
MF:C10H13NO4
MW:211.214523077011
CID:2788828
PubChem ID:71346900
Update Time:2025-04-21
4-Pyridinepropanoic acid, acetate Chemical and Physical Properties
Names and Identifiers
-
- 3-(Pyridin-4-yl)propanoic acid--acetic acid (1/1)
- Acetic acid;3-pyridin-4-ylpropanoic acid
- 4-Pyridinepropanoic acid, acetate
- FSR6W7V8NX
- 195375-38-3
- DTXSID10772862
-
- Inchi： 1S/C8H9NO2.C2H4O2/c10-8(11)2-1-7-3-5-9-6-4-7;1-2(3)4/h3-6H,1-2H2,(H,10,11);1H3,(H,3,4)
- InChI Key： ODSRSJGBCBQXOG-UHFFFAOYSA-N
- SMILES： OC(CCC1C=CN=CC=1)=O.OC(C)=O
Computed Properties
- Exact Mass: 211.08445790Da
- Monoisotopic Mass: 211.08445790Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 161
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 87.5?2
4-Pyridinepropanoic acid, acetate Related Literature
-
Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Xingqun Zheng,Lele Song,Xin Feng,Li Li,Zidong Wei J. Mater. Chem. A, 2020,8, 14145-14151
-
Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
-
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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