Cas no 33322-64-4 (3-f-c6h4con(ch3)2)
3-f-c6h4con(ch3)2 structure
Product Name:3-f-c6h4con(ch3)2
CAS No:33322-64-4
MF:C9H10FNO
MW:167.180205821991
CID:917844
PubChem ID:6432345
Update Time:2025-04-19
3-f-c6h4con(ch3)2 Chemical and Physical Properties
Names and Identifiers
-
- 3-f-c6h4con(ch3)2
- Z32014725
- 3-Fluoro-N,N-dimethyl-benzamide
- MFCD11726128
- 3-fluoro-N,N-dimethylbenzamide
- AKOS008932977
- 33322-64-4
- SCHEMBL255000
- DTXSID001305261
-
- Inchi： 1S/C9H10FNO/c1-11(2)9(12)7-4-3-5-8(10)6-7/h3-6H,1-2H3
- InChI Key： UEUFYQYJMJNMCG-UHFFFAOYSA-N
- SMILES： FC1=CC=CC(=C1)C(N(C)C)=O
Computed Properties
- Exact Mass: 167.0747
- Monoisotopic Mass: 167.074642105g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 170
- 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: 2.1
- Topological Polar Surface Area: 20.3?2
Experimental Properties
- PSA: 20.31
3-f-c6h4con(ch3)2 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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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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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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