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106658-74-6 | 7(1H)-Indolizinone, hexahydro-5-methyl-, trans-
CAS No: 106658-74-6 Catalog No: AG0083GF MDL No:
Product Description
Catalog Number:
AG0083GF
Chemical Name:
7(1H)-Indolizinone, hexahydro-5-methyl-, trans-
CAS Number:
106658-74-6
Molecular Formula:
C9H15NO
Molecular Weight:
153.2215
IUPAC Name:
(5S,8aR)-5-methyl-2,3,5,6,8,8a-hexahydro-1H-indolizin-7-one
InChI:
InChI=1S/C9H15NO/c1-7-5-9(11)6-8-3-2-4-10(7)8/h7-8H,2-6H2,1H3/t7-,8+/m0/s1
InChI Key:
BZQPIMJDHXCWPX-JGVFFNPUSA-N
SMILES:
O=C1C[C@H](C)N2[C@@H](C1)CCC2
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:
2
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:
0.7
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