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94717-69-8 | Acetamide, N-(1-butyl-1,2,3,4-tetrahydro-2,2,4-trimethyl-7-quinolinyl)-
CAS No: 94717-69-8 Catalog No: AG005VQC MDL No:
Product Description
Catalog Number:
AG005VQC
Chemical Name:
Acetamide, N-(1-butyl-1,2,3,4-tetrahydro-2,2,4-trimethyl-7-quinolinyl)-
CAS Number:
94717-69-8
Molecular Formula:
C18H28N2O
Molecular Weight:
288.4277
IUPAC Name:
N-(1-butyl-2,2,4-trimethyl-3,4-dihydroquinolin-7-yl)acetamide
InChI:
InChI=1S/C18H28N2O/c1-6-7-10-20-17-11-15(19-14(3)21)8-9-16(17)13(2)12-18(20,4)5/h8-9,11,13H,6-7,10,12H2,1-5H3,(H,19,21)
InChI Key:
MXSHIKMHIBDZJL-UHFFFAOYSA-N
SMILES:
CCCCN1c2cc(ccc2C(CC1(C)C)C)NC(=O)C
Properties
Complexity:
366
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.22g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
288.435g/mol
Monoisotopic Mass:
288.22g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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