Cas no 3110-40-5 (4(3H)-Pyrimidinone,2-(fluoromethyl)-5-methyl-)
3110-40-5 structure
Product Name:4(3H)-Pyrimidinone,2-(fluoromethyl)-5-methyl-
CAS No:3110-40-5
MF:C6H7FN2O
MW:142.130984544754
CID:294839
PubChem ID:22947838
Update Time:2025-04-19
4(3H)-Pyrimidinone,2-(fluoromethyl)-5-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 4(3H)-Pyrimidinone,2-(fluoromethyl)-5-methyl-
- 4-Pyrimidinol,2-(fluoromethyl)-5-methyl- (6CI,8CI)
- 2-(Fluoromethyl)-5-methylpyrimidin-4(3H)-one
- 3110-40-5
-
- Inchi： 1S/C6H7FN2O/c1-4-3-8-5(2-7)9-6(4)10/h3H,2H2,1H3,(H,8,9,10)
- InChI Key： GEVMMYSAKXNKFE-UHFFFAOYSA-N
- SMILES： FCC1=NC=C(C)C(N1)=O
Computed Properties
- Exact Mass: 142.05431
- Monoisotopic Mass: 142.05424101g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 220
- 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: 0
- Topological Polar Surface Area: 41.5?2
Experimental Properties
- PSA: 41.46
4(3H)-Pyrimidinone,2-(fluoromethyl)-5-methyl- Related Literature
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
-
Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
3110-40-5 (4(3H)-Pyrimidinone,2-(fluoromethyl)-5-methyl-) Related Products
- 16071-29-7(4(3H)-Pyrimidinone,6-(hydroxyamino)-2-methyl-)
- 13265-40-2(4(3H)-Pyrimidinone,2,6-diamino-5-methyl-)
- 18378-79-5(4(3H)-Pyrimidinone,2-(1,1-dimethylethyl)-6-hydroxy-)
- 127892-80-2(4(3H)-Pyrimidinone,2-methyl-)
- 19875-04-8(4-Hydroxy-2-methylpyrimidine)
- 51953-17-4(4-Hydroxypyrimidine)
- 53135-22-1(5-Amino-2-methylpyrimidin-4(3H)-one)
- 153445-43-3(4(3H)-Pyrimidinone,2-hydroxy-5-methyl-)
- 161123-95-1(5-Pyrimidinecarboxaldehyde,2-fluoro-1,6-dihydro-6-oxo-)
- 16357-82-7(6-oxo-1,6-dihydropyrimidine-5-carbaldehyde)
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