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158658-59-4 | Quinoline, 6-butoxy-1,2-dihydro-2,2,4-trimethyl-
CAS No: 158658-59-4 Catalog No: AG001QPV MDL No:
Product Description
Catalog Number:
AG001QPV
Chemical Name:
Quinoline, 6-butoxy-1,2-dihydro-2,2,4-trimethyl-
CAS Number:
158658-59-4
Molecular Formula:
C16H23NO
Molecular Weight:
245.3599
IUPAC Name:
6-butoxy-2,2,4-trimethyl-1H-quinoline
InChI:
InChI=1S/C16H23NO/c1-5-6-9-18-13-7-8-15-14(10-13)12(2)11-16(3,4)17-15/h7-8,10-11,17H,5-6,9H2,1-4H3
InChI Key:
CYGLRZLOPXMGKF-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc2c(c1)C(=CC(N2)(C)C)C
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.178g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.366g/mol
Monoisotopic Mass:
245.178g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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