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Home > Indoles and Oxindole > 144356-41-2
144356-41-2 | 1H-Isoindole-1,3(2H)-dione, 2-(4,4-dimethoxypentyl)-
CAS No: 144356-41-2 Catalog No: AG001JEM MDL No:
Product Description
Catalog Number:
AG001JEM
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 2-(4,4-dimethoxypentyl)-
CAS Number:
144356-41-2
Molecular Formula:
C15H19NO4
Molecular Weight:
277.3157
IUPAC Name:
2-(4,4-dimethoxypentyl)isoindole-1,3-dione
InChI:
InChI=1S/C15H19NO4/c1-15(19-2,20-3)9-6-10-16-13(17)11-7-4-5-8-12(11)14(16)18/h4-5,7-8H,6,9-10H2,1-3H3
InChI Key:
GJMVTTCQLBIQCW-UHFFFAOYSA-N
SMILES:
COC(CCCN1C(=O)c2c(C1=O)cccc2)(OC)C
Properties
Complexity:
354
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.131g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.32g/mol
Monoisotopic Mass:
277.131g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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