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1359704-87-2 | 6-Iodobenzo[d][1,2,3]triazin-4(3h)-one
CAS No: 1359704-87-2 Catalog No: AG00HUF4 MDL No:
Product Description
Catalog Number:
AG00HUF4
Chemical Name:
6-Iodobenzo[d][1,2,3]triazin-4(3h)-one
CAS Number:
1359704-87-2
IUPAC Name:
6-iodo-3H-1,2,3-benzotriazin-4-one
InChI:
InChI=1S/C7H4IN3O/c8-4-1-2-6-5(3-4)7(12)10-11-9-6/h1-3H,(H,9,10,12)
InChI Key:
KWROEIXIUUADOS-UHFFFAOYSA-N
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.94g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
273.033g/mol
Monoisotopic Mass:
272.94g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
53.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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