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32615-82-0 | 5-iodo-1H-benzo[d][1,3]oxazine-2,4-dione
CAS No: 32615-82-0 Catalog No: AG01DJ2G MDL No:MFCD28679893
Product Description
Catalog Number:
AG01DJ2G
Chemical Name:
5-iodo-1H-benzo[d][1,3]oxazine-2,4-dione
CAS Number:
32615-82-0
Molecular Formula:
C8H4INO3
Molecular Weight:
289.0267
MDL Number:
MFCD28679893
IUPAC Name:
5-iodo-1H-3,1-benzoxazine-2,4-dione
InChI:
InChI=1S/C8H4INO3/c9-4-2-1-3-5-6(4)7(11)13-8(12)10-5/h1-3H,(H,10,12)
InChI Key:
RAADLXMPZLKGDQ-UHFFFAOYSA-N
SMILES:
O=c1oc(=O)c2c([nH]1)cccc2I
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.924g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
289.028g/mol
Monoisotopic Mass:
288.924g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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