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847248-44-6 | Quinoline,6-(3,4-dihydro-2H-pyrrol-5-yl)-
CAS No: 847248-44-6 Catalog No: AG004SAL MDL No:MFCD09749696
Product Description
Catalog Number:
AG004SAL
Chemical Name:
Quinoline,6-(3,4-dihydro-2H-pyrrol-5-yl)-
CAS Number:
847248-44-6
Molecular Formula:
C13H12N2
Molecular Weight:
196.2478
MDL Number:
MFCD09749696
IUPAC Name:
6-(3,4-dihydro-2H-pyrrol-5-yl)quinoline
InChI:
InChI=1S/C13H12N2/c1-3-10-9-11(12-4-2-8-14-12)5-6-13(10)15-7-1/h1,3,5-7,9H,2,4,8H2
InChI Key:
IAPOJJPFEQXKLL-UHFFFAOYSA-N
SMILES:
C1CN=C(C1)c1ccc2c(c1)cccn2
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.1g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.253g/mol
Monoisotopic Mass:
196.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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