Name: Name:2-(3-oxocycloheptyl)-2,3-dihydro-1H-isoindole-1,3-dione
Brand: Angene
SKU: AG01A1DD
Rating: 90 (10 reviews)

2-(3-oxocycloheptyl)-2,3-dihydro-1H-isoindole-1,3-dione

CAS No.:

1423029-25-7

Catalog Number:

AG01A1DD

Molecular Formula:

C15H15NO3

Molecular Weight:

257.2845

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

Complexity:

394

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

257.105g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

257.289g/mol

Monoisotopic Mass:

257.105g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5