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Home > Indoles and Oxindole > 80664-59-1
80664-59-1 | 3(2H)-Indolizinone, hexahydro-8-methyl-, trans-
CAS No: 80664-59-1 Catalog No: AG005JZP MDL No:
Product Description
Catalog Number:
AG005JZP
Chemical Name:
3(2H)-Indolizinone, hexahydro-8-methyl-, trans-
CAS Number:
80664-59-1
Molecular Formula:
C9H15NO
Molecular Weight:
153.2215
IUPAC Name:
(8R,8aR)-8-methyl-2,5,6,7,8,8a-hexahydro-1H-indolizin-3-one
InChI:
InChI=1S/C9H15NO/c1-7-3-2-6-10-8(7)4-5-9(10)11/h7-8H,2-6H2,1H3/t7-,8-/m1/s1
InChI Key:
UIPIFRBRNRAGAX-HTQZYQBOSA-N
SMILES:
C[C@@H]1CCCN2[C@@H]1CCC2=O
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
153.115g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
153.225g/mol
Monoisotopic Mass:
153.115g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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