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Home > Indoles and Oxindole > 820973-54-4
820973-54-4 | 1H-Isoindole-1,3(2H)-dione, 2-[4-(4-ethenylphenyl)butyl]-
CAS No: 820973-54-4 Catalog No: AG004WYS MDL No:
Product Description
Catalog Number:
AG004WYS
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 2-[4-(4-ethenylphenyl)butyl]-
CAS Number:
820973-54-4
Molecular Formula:
C20H19NO2
Molecular Weight:
305.3704
IUPAC Name:
2-[4-(4-ethenylphenyl)butyl]isoindole-1,3-dione
InChI:
InChI=1S/C20H19NO2/c1-2-15-10-12-16(13-11-15)7-5-6-14-21-19(22)17-8-3-4-9-18(17)20(21)23/h2-4,8-13H,1,5-7,14H2
InChI Key:
ONDGYDIXZVBQHJ-UHFFFAOYSA-N
SMILES:
C=Cc1ccc(cc1)CCCCN1C(=O)c2c(C1=O)cccc2
Properties
Complexity:
427
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.142g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
305.377g/mol
Monoisotopic Mass:
305.142g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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