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Home > Indoles and Oxindole > 923604-74-4
923604-74-4 | 1H-Isoindole-1,3(2H)-dione, 2-(6-hepten-1-yl)-
CAS No: 923604-74-4 Catalog No: AG0066Q3 MDL No:
Product Description
Catalog Number:
AG0066Q3
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 2-(6-hepten-1-yl)-
CAS Number:
923604-74-4
Molecular Formula:
C15H17NO2
Molecular Weight:
243.3010
IUPAC Name:
2-hept-6-enylisoindole-1,3-dione
InChI:
InChI=1S/C15H17NO2/c1-2-3-4-5-8-11-16-14(17)12-9-6-7-10-13(12)15(16)18/h2,6-7,9-10H,1,3-5,8,11H2
InChI Key:
QSKKXENHRGBDRY-UHFFFAOYSA-N
SMILES:
C=CCCCCCN1C(=O)c2c(C1=O)cccc2
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.126g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.306g/mol
Monoisotopic Mass:
243.126g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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