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138642-39-4 | 4(1H)-Quinolinone, 2-ethyl-5,6,7,8-tetrahydro-
CAS No: 138642-39-4 Catalog No: AG0018XO MDL No:
Product Description
Catalog Number:
AG0018XO
Chemical Name:
4(1H)-Quinolinone, 2-ethyl-5,6,7,8-tetrahydro-
CAS Number:
138642-39-4
Molecular Formula:
C11H15NO
Molecular Weight:
177.2429
IUPAC Name:
2-ethyl-5,6,7,8-tetrahydro-1H-quinolin-4-one
InChI:
InChI=1S/C11H15NO/c1-2-8-7-11(13)9-5-3-4-6-10(9)12-8/h7H,2-6H2,1H3,(H,12,13)
InChI Key:
NJWGRRJXPYNYFY-UHFFFAOYSA-N
SMILES:
CCc1cc(=O)c2c([nH]1)CCCC2
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.115g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.247g/mol
Monoisotopic Mass:
177.115g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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