Cas no 39256-40-1 (5-butyl-2-Pyridinecarbonitrile)
39256-40-1 structure
Product Name:5-butyl-2-Pyridinecarbonitrile
CAS No:39256-40-1
MF:C10H12N2
MW:160.215682029724
CID:319140
PubChem ID:329377
Update Time:2025-04-19
5-butyl-2-Pyridinecarbonitrile Chemical and Physical Properties
Names and Identifiers
-
- 2-Pyridinecarbonitrile,5-butyl-
- 5-butyl-2-Pyridinecarbonitrile
- 5-butylpyridine-2-carbonitrile
- 5-butyl-pyridine-2-carbonitrile
- 5-n-butyl-2-cyanopyridine
- 5-n-Butylpicolinonitril
- AC1L74M4
- NSC311722
- SCHEMBL10465159
- VRVNMOVNIOVKTF-UHFFFAOYSA-N
- 39256-40-1
- NSC-311722
- DTXSID80317143
-
- Inchi: 1S/C10H12N2/c1-2-3-4-9-5-6-10(7-11)12-8-9/h5-6,8H,2-4H2,1H3
- InChI Key: VRVNMOVNIOVKTF-UHFFFAOYSA-N
- SMILES: N1C(C#N)=CC=C(C=1)CCCC
Computed Properties
- Exact Mass: 160.10016
- Monoisotopic Mass: 160.100048391g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 168
- 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: 2.8
- Topological Polar Surface Area: 36.7?2
Experimental Properties
- PSA: 36.68
- LogP: 2.29588
5-butyl-2-Pyridinecarbonitrile Related Literature
-
Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
-
Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
-
Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
39256-40-1 (5-butyl-2-Pyridinecarbonitrile) Related Products
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