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89228-39-7 | Quinoline, 2-ethyl-1,2,3,4-tetrahydro-6-methyl-
CAS No: 89228-39-7 Catalog No: AG0044H0 MDL No:
Product Description
Catalog Number:
AG0044H0
Chemical Name:
Quinoline, 2-ethyl-1,2,3,4-tetrahydro-6-methyl-
CAS Number:
89228-39-7
Molecular Formula:
C12H17N
Molecular Weight:
175.2701
IUPAC Name:
2-ethyl-6-methyl-1,2,3,4-tetrahydroquinoline
InChI:
InChI=1S/C12H17N/c1-3-11-6-5-10-8-9(2)4-7-12(10)13-11/h4,7-8,11,13H,3,5-6H2,1-2H3
InChI Key:
DXPAGJSIFYUMTR-UHFFFAOYSA-N
SMILES:
CCC1CCc2c(N1)ccc(c2)C
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.136g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.275g/mol
Monoisotopic Mass:
175.136g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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