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Home > Indoles and Oxindole > 1423029-25-7
1423029-25-7 | 2-(3-oxocycloheptyl)-2,3-dihydro-1H-isoindole-1,3-dione
CAS No: 1423029-25-7 Catalog No: AG01A1DD MDL No:MFCD22565865
Product Description
Catalog Number:
AG01A1DD
Chemical Name:
2-(3-oxocycloheptyl)-2,3-dihydro-1H-isoindole-1,3-dione
CAS Number:
1423029-25-7
Molecular Formula:
C15H15NO3
Molecular Weight:
257.2845
MDL Number:
MFCD22565865
IUPAC Name:
2-(3-oxocycloheptyl)isoindole-1,3-dione
InChI:
InChI=1S/C15H15NO3/c17-11-6-2-1-5-10(9-11)16-14(18)12-7-3-4-8-13(12)15(16)19/h3-4,7-8,10H,1-2,5-6,9H2
InChI Key:
YPBLZWKNRAQYQM-UHFFFAOYSA-N
SMILES:
O=C1CCCCC(C1)N1C(=O)c2c(C1=O)cccc2
Properties
Complexity:
394
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.105g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.289g/mol
Monoisotopic Mass:
257.105g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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