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Home > Indoles and Oxindole > 89423-09-6
89423-09-6 | 1H-Isoindole-1,3(2H)-dione, 2-tetradecyl-
CAS No: 89423-09-6 Catalog No: AG0043P0 MDL No:
Product Description
Catalog Number:
AG0043P0
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 2-tetradecyl-
CAS Number:
89423-09-6
Molecular Formula:
C22H33NO2
Molecular Weight:
343.5029
IUPAC Name:
2-tetradecylisoindole-1,3-dione
InChI:
InChI=1S/C22H33NO2/c1-2-3-4-5-6-7-8-9-10-11-12-15-18-23-21(24)19-16-13-14-17-20(19)22(23)25/h13-14,16-17H,2-12,15,18H2,1H3
InChI Key:
UJSXGXQZWRLIJX-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCN1C(=O)c2c(C1=O)cccc2
Properties
Complexity:
383
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
343.251g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
343.511g/mol
Monoisotopic Mass:
343.251g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.2
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