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19117-51-2 | Pentanedioyl dichloride, 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-
CAS No: 19117-51-2 Catalog No: AG002F3H MDL No:
Product Description
Catalog Number:
AG002F3H
Chemical Name:
Pentanedioyl dichloride, 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-
CAS Number:
19117-51-2
Molecular Formula:
C13H9Cl2NO4
Molecular Weight:
314.1209
IUPAC Name:
2-(1,3-dioxoisoindol-2-yl)pentanedioyl dichloride
InChI:
InChI=1S/C13H9Cl2NO4/c14-10(17)6-5-9(11(15)18)16-12(19)7-3-1-2-4-8(7)13(16)20/h1-4,9H,5-6H2
InChI Key:
UZELHZBICNHBGL-UHFFFAOYSA-N
SMILES:
ClC(=O)CCC(N1C(=O)c2c(C1=O)cccc2)C(=O)Cl
Properties
Complexity:
441
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.991g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
314.118g/mol
Monoisotopic Mass:
312.991g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
71.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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