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854892-08-3 | 6-Iodo-cinnolin-4-ol
CAS No: 854892-08-3 Catalog No: AG00G9CR MDL No:MFCD28140169
Product Description
Catalog Number:
AG00G9CR
Chemical Name:
6-Iodo-cinnolin-4-ol
CAS Number:
854892-08-3
MDL Number:
MFCD28140169
IUPAC Name:
6-iodo-1H-cinnolin-4-one
InChI:
InChI=1S/C8H5IN2O/c9-5-1-2-7-6(3-5)8(12)4-10-11-7/h1-4H,(H,11,12)
InChI Key:
DVMKVCRSEMFWRI-UHFFFAOYSA-N
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.945g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
272.045g/mol
Monoisotopic Mass:
271.945g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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