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88187-33-1 | 2,5-Azocinedione, hexahydro-1,6-dimethyl-
CAS No: 88187-33-1 Catalog No: AG004CD8 MDL No:
Product Description
Catalog Number:
AG004CD8
Chemical Name:
2,5-Azocinedione, hexahydro-1,6-dimethyl-
CAS Number:
88187-33-1
Molecular Formula:
C9H15NO2
Molecular Weight:
169.2209
IUPAC Name:
1,6-dimethylazocane-2,5-dione
InChI:
InChI=1S/C9H15NO2/c1-7-5-6-10(2)9(12)4-3-8(7)11/h7H,3-6H2,1-2H3
InChI Key:
LIXBVUKWLWIBHK-UHFFFAOYSA-N
SMILES:
CC1CCN(C)C(=O)CCC1=O
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.11g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.224g/mol
Monoisotopic Mass:
169.11g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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