Cas no 23723-23-1 (3-Pyridinecarboxylicacid, 5-fluoro-, butyl ester)
23723-23-1 structure
Product Name:3-Pyridinecarboxylicacid, 5-fluoro-, butyl ester
CAS No:23723-23-1
MF:C10H12FNO2
MW:197.206186294556
CID:263540
PubChem ID:211890
Update Time:2025-04-19
3-Pyridinecarboxylicacid, 5-fluoro-, butyl ester Chemical and Physical Properties
Names and Identifiers
-
- 3-Pyridinecarboxylicacid, 5-fluoro-, butyl ester
- butyl 5-fluoropyridine-3-carboxylate
- 5-Fluor-nicotinbutylester
- 5-fluoro-nicotinic acid butyl ester
- AC1L4RRU
- AC1Q66WD
- AR-1K7322
- BRN 0474653
- Butyl 5-fluoro-3-pyridinecarboxylate
- Butyl 5-fluoronicotinate
- CTK4F2108
- n-Butyl-5-fluornicotinat
- nicotinic acid, 5-fluoro-, butyl ester(8ci)
- 3-Pyridinecarboxylic acid, 5-fluoro-, butyl ester
- DTXSID70178386
- 23723-23-1
- Nicotinic acid, 5-fluoro-, butyl ester
- Nicotinic acid, 5-fluoro-, butyl ester (8CI)
-
- Inchi： 1S/C10H12FNO2/c1-2-3-4-14-10(13)8-5-9(11)7-12-6-8/h5-7H,2-4H2,1H3
- InChI Key： ZQNIMWGAXXYCBH-UHFFFAOYSA-N
- SMILES： FC1=CN=CC(=C1)C(=O)OCCCC
Computed Properties
- Exact Mass: 197.08526
- Monoisotopic Mass: 197.085
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 5
- Complexity: 187
- 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: 2.4
- Topological Polar Surface Area: 39.2?2
Experimental Properties
- Density: 1.131
- Boiling Point: 251.6°Cat760mmHg
- Flash Point: 106°C
- Refractive Index: 1.485
- PSA: 39.19
3-Pyridinecarboxylicacid, 5-fluoro-, butyl ester Related Literature
-
Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
-
Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
23723-23-1 (3-Pyridinecarboxylicacid, 5-fluoro-, butyl ester) Related Products
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