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1010-82-8 | 5(1H)-Quinolinone, 2,3,4,6,7,8-hexahydro-7,7-dimethyl-
CAS No: 1010-82-8 Catalog No: AG0003HJ MDL No:
Product Description
Catalog Number:
AG0003HJ
Chemical Name:
5(1H)-Quinolinone, 2,3,4,6,7,8-hexahydro-7,7-dimethyl-
CAS Number:
1010-82-8
Molecular Formula:
C11H17NO
Molecular Weight:
179.2588
IUPAC Name:
7,7-dimethyl-1,2,3,4,6,8-hexahydroquinolin-5-one
InChI:
InChI=1S/C11H17NO/c1-11(2)6-9-8(10(13)7-11)4-3-5-12-9/h12H,3-7H2,1-2H3
InChI Key:
UKUDDGOWCUCRFI-UHFFFAOYSA-N
SMILES:
O=C1CC(C)(C)CC2=C1CCCN2
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.131g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.263g/mol
Monoisotopic Mass:
179.131g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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