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71478-57-4 | 4H-3,1-Benzoxazin-4-one, 8-iodo-2-methyl-
CAS No: 71478-57-4 Catalog No: AG00IC65 MDL No:
Product Description
Catalog Number:
AG00IC65
Chemical Name:
4H-3,1-Benzoxazin-4-one, 8-iodo-2-methyl-
CAS Number:
71478-57-4
IUPAC Name:
8-iodo-2-methyl-3,1-benzoxazin-4-one
InChI:
InChI=1S/C9H6INO2/c1-5-11-8-6(9(12)13-5)3-2-4-7(8)10/h2-4H,1H3
InChI Key:
CWJKKXJAXYIUCR-UHFFFAOYSA-N
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.944g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.056g/mol
Monoisotopic Mass:
286.944g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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