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1262416-25-0 | 5-Chloro-6-iodoisoindolin-1-one
CAS No: 1262416-25-0 Catalog No: AG000SER MDL No:MFCD19443338
Product Description
Catalog Number:
AG000SER
Chemical Name:
5-Chloro-6-iodoisoindolin-1-one
CAS Number:
1262416-25-0
Molecular Formula:
C8H5ClINO
Molecular Weight:
293.4889
MDL Number:
MFCD19443338
IUPAC Name:
5-chloro-6-iodo-2,3-dihydroisoindol-1-one
InChI:
InChI=1S/C8H5ClINO/c9-6-1-4-3-11-8(12)5(4)2-7(6)10/h1-2H,3H2,(H,11,12)
InChI Key:
ZALBOOFGCKNNOM-UHFFFAOYSA-N
SMILES:
O=C1NCc2c1cc(I)c(c2)Cl
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.91g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
293.488g/mol
Monoisotopic Mass:
292.91g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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