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67082-08-0 | Quinoline, 1,2-dihydro-2,2,4-trimethyl-6-(1-methylethoxy)-
CAS No: 67082-08-0 Catalog No: AG00648V MDL No:
Product Description
Catalog Number:
AG00648V
Chemical Name:
Quinoline, 1,2-dihydro-2,2,4-trimethyl-6-(1-methylethoxy)-
CAS Number:
67082-08-0
Molecular Formula:
C15H21NO
Molecular Weight:
231.3333
IUPAC Name:
2,2,4-trimethyl-6-propan-2-yloxy-1H-quinoline
InChI:
InChI=1S/C15H21NO/c1-10(2)17-12-6-7-14-13(8-12)11(3)9-15(4,5)16-14/h6-10,16H,1-5H3
InChI Key:
CHULUTAEUIQYRE-UHFFFAOYSA-N
SMILES:
CC(Oc1ccc2c(c1)C(=CC(N2)(C)C)C)C
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.162g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
231.339g/mol
Monoisotopic Mass:
231.162g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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