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Home > Indoles and Oxindole > 88124-92-9
88124-92-9 | 1H-Isoindole-1,3(2H)-dione, 2-(3,7-dimethyl-6-octenyl)-
CAS No: 88124-92-9 Catalog No: AG004IG8 MDL No:
Product Description
Catalog Number:
AG004IG8
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 2-(3,7-dimethyl-6-octenyl)-
CAS Number:
88124-92-9
Molecular Formula:
C18H23NO2
Molecular Weight:
285.3807
IUPAC Name:
2-(3,7-dimethyloct-6-enyl)isoindole-1,3-dione
InChI:
InChI=1S/C18H23NO2/c1-13(2)7-6-8-14(3)11-12-19-17(20)15-9-4-5-10-16(15)18(19)21/h4-5,7,9-10,14H,6,8,11-12H2,1-3H3
InChI Key:
KWOJKXYYJYAKFT-UHFFFAOYSA-N
SMILES:
CC(CCC=C(C)C)CCN1C(=O)c2c(C1=O)cccc2
Properties
Complexity:
399
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.173g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.387g/mol
Monoisotopic Mass:
285.173g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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