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88579-24-2 | Ethanone, 1-(1,2,3,4-tetrahydro-1,4,4-trimethyl-6-quinolinyl)-
CAS No: 88579-24-2 Catalog No: AG004BDK MDL No:
Product Description
Catalog Number:
AG004BDK
Chemical Name:
Ethanone, 1-(1,2,3,4-tetrahydro-1,4,4-trimethyl-6-quinolinyl)-
CAS Number:
88579-24-2
Molecular Formula:
C14H19NO
Molecular Weight:
217.3068
IUPAC Name:
1-(1,4,4-trimethyl-2,3-dihydroquinolin-6-yl)ethanone
InChI:
InChI=1S/C14H19NO/c1-10(16)11-5-6-13-12(9-11)14(2,3)7-8-15(13)4/h5-6,9H,7-8H2,1-4H3
InChI Key:
HXVMRSPZWJJPKO-UHFFFAOYSA-N
SMILES:
CN1CCC(c2c1ccc(c2)C(=O)C)(C)C
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.147g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.312g/mol
Monoisotopic Mass:
217.147g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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