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88343-21-9 | 6-Quinolineethanol, 1-acetyl-1,2,3,4-tetrahydro-
CAS No: 88343-21-9 Catalog No: AG0047SA MDL No:
Product Description
Catalog Number:
AG0047SA
Chemical Name:
6-Quinolineethanol, 1-acetyl-1,2,3,4-tetrahydro-
CAS Number:
88343-21-9
Molecular Formula:
C13H17NO2
Molecular Weight:
219.2796
IUPAC Name:
1-[6-(2-hydroxyethyl)-3,4-dihydro-2H-quinolin-1-yl]ethanone
InChI:
InChI=1S/C13H17NO2/c1-10(16)14-7-2-3-12-9-11(6-8-15)4-5-13(12)14/h4-5,9,15H,2-3,6-8H2,1H3
InChI Key:
VEGVTUMHUAXOBG-UHFFFAOYSA-N
SMILES:
OCCc1ccc2c(c1)CCCN2C(=O)C
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.126g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.284g/mol
Monoisotopic Mass:
219.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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