Cas no 20668-43-3 (Quinoline, 3-propyl-)
Quinoline, 3-propyl- structure
Product Name:Quinoline, 3-propyl-
CAS No:20668-43-3
MF:C12H13N
MW:171.238322973251
CID:284317
PubChem ID:146545
Update Time:2025-04-19
Quinoline, 3-propyl- Chemical and Physical Properties
Names and Identifiers
-
- Quinoline, 3-propyl-
- 3-propylquinoline
- SCHEMBL6115113
- DTXSID80174713
- 3-Propylquinoline #
- AKOS006373678
- ANBUXLFLKGJLEL-UHFFFAOYSA-N
- 20668-43-3
-
- Inchi： 1S/C12H13N/c1-2-5-10-8-11-6-3-4-7-12(11)13-9-10/h3-4,6-9H,2,5H2,1H3
- InChI Key： ANBUXLFLKGJLEL-UHFFFAOYSA-N
- SMILES： N1C=C(C=C2C=CC=CC=12)CCC
Computed Properties
- Exact Mass: 171.10489
- Monoisotopic Mass: 171.104799419g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 155
- 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: 3.5
- Topological Polar Surface Area: 12.9?2
Experimental Properties
- PSA: 12.89
Quinoline, 3-propyl- Related Literature
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1. Intramolecular nitrene insertions into aromatic and heteroaromatic systems. Part II. Insertions into thiophen ringsGeoffrey R. Cliff,Gurnos Jones,John McK. Woollard J. Chem. Soc. Perkin Trans. 1 1974 2072
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Hans Vander Mierde,Nele Ledoux,Bart Allaert,Pascal Van Der Voort,Renata Drozdzak,Dirk De Vos,Francis Verpoort New J. Chem. 2007 31 1572
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T. A. Bryson,J. M. Gibson,J. J. Stewart,H. Voegtle,A. Tiwari,J. H. Dawson,W. Marley,B. Harmon Green Chem. 2003 5 177
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Saghir Ali,Radhakrishna Gattu,Varun Singh,Santa Mondal,Abu T. Khan,Gurudutt Dubey,P. V. Bharatam Org. Biomol. Chem. 2020 18 1785
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Long-Yi Xi,Ruo-Yi Zhang,Lei Zhang,Shan-Yong Chen,Xiao-Qi Yu Org. Biomol. Chem. 2015 13 3924
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