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Home > Indoles and Oxindole > 138175-32-3
138175-32-3 | 1H-Isoindole-1,3(2H)-dione, 2-(5-methyl-3-oxohexyl)-
CAS No: 138175-32-3 Catalog No: AG00184K MDL No:
Product Description
Catalog Number:
AG00184K
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 2-(5-methyl-3-oxohexyl)-
CAS Number:
138175-32-3
Molecular Formula:
C15H17NO3
Molecular Weight:
259.3004
IUPAC Name:
2-(5-methyl-3-oxohexyl)isoindole-1,3-dione
InChI:
InChI=1S/C15H17NO3/c1-10(2)9-11(17)7-8-16-14(18)12-5-3-4-6-13(12)15(16)19/h3-6,10H,7-9H2,1-2H3
InChI Key:
QHSUEZAUMGYDEU-UHFFFAOYSA-N
SMILES:
CC(CC(=O)CCN1C(=O)c2c(C1=O)cccc2)C
Properties
Complexity:
365
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.121g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.305g/mol
Monoisotopic Mass:
259.121g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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