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Home > Indoles and Oxindole > 6626-69-3
6626-69-3 | 2,6-di(pentan-2-yl)pyrrolo[3,4-f]isoindole-1,3,5,7(2h,6h)-tetrone
CAS No: 6626-69-3 Catalog No: AG006OK7 MDL No:
Product Description
Catalog Number:
AG006OK7
Chemical Name:
2,6-di(pentan-2-yl)pyrrolo[3,4-f]isoindole-1,3,5,7(2h,6h)-tetrone
CAS Number:
6626-69-3
Molecular Formula:
C20H24N2O4
Molecular Weight:
356.4156
IUPAC Name:
2,6-di(pentan-2-yl)pyrrolo[3,4-f]isoindole-1,3,5,7-tetrone
InChI:
InChI=1S/C20H24N2O4/c1-5-7-11(3)21-17(23)13-9-15-16(10-14(13)18(21)24)20(26)22(19(15)25)12(4)8-6-2/h9-12H,5-8H2,1-4H3
InChI Key:
ZNLBGUXRQXXHQS-UHFFFAOYSA-N
SMILES:
CCCC(n1c(=O)c2c(c1=O)cc1c(c2)c(=O)n(c1=O)C(CCC)C)C
NSC Number:
58276
Properties
Complexity:
537
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
356.174g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
356.422g/mol
Monoisotopic Mass:
356.174g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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