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1416447-74-9 | Quinoline, 8-ethyl-2,5-dimethyl-
CAS No: 1416447-74-9 Catalog No: AG001GTL MDL No:
Product Description
Catalog Number:
AG001GTL
Chemical Name:
Quinoline, 8-ethyl-2,5-dimethyl-
CAS Number:
1416447-74-9
Molecular Formula:
C13H15N
Molecular Weight:
185.2649
IUPAC Name:
8-ethyl-2,5-dimethylquinoline
InChI:
InChI=1S/C13H15N/c1-4-11-7-5-9(2)12-8-6-10(3)14-13(11)12/h5-8H,4H2,1-3H3
InChI Key:
CJDDZWALNFEDGF-UHFFFAOYSA-N
SMILES:
CCc1ccc(c2c1nc(C)cc2)C
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.12g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.27g/mol
Monoisotopic Mass:
185.12g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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