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1187169-90-9

1187169-90-9 | 3-(5-Chloro-2-thienyl)quinoline

CAS No: 1187169-90-9 Catalog No: AG01FETM MDL No:

Product Description

Catalog Number:
AG01FETM
Chemical Name:
3-(5-Chloro-2-thienyl)quinoline
CAS Number:
1187169-90-9
Molecular Formula:
C13H8ClNS
Molecular Weight:
245.7273
IUPAC Name:
3-(5-chlorothiophen-2-yl)quinoline
InChI:
InChI=1S/C13H8ClNS/c14-13-6-5-12(16-13)10-7-9-3-1-2-4-11(9)15-8-10/h1-8H
InChI Key:
PYVFGZXEHYYSCW-UHFFFAOYSA-N
SMILES:
Clc1ccc(s1)c1cnc2c(c1)cccc2

Properties

Complexity:
248  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.007g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.724g/mol
Monoisotopic Mass:
245.007g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5  

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