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586330-45-2 | 3-IODO-5-METHYL-6-NITRO-1H-INDAZOLE
CAS No: 586330-45-2 Catalog No: AG00EZ3Z MDL No:
Product Description
Catalog Number:
AG00EZ3Z
Chemical Name:
3-IODO-5-METHYL-6-NITRO-1H-INDAZOLE
CAS Number:
586330-45-2
IUPAC Name:
3-iodo-5-methyl-6-nitro-2H-indazole
InChI:
InChI=1S/C8H6IN3O2/c1-4-2-5-6(10-11-8(5)9)3-7(4)12(13)14/h2-3H,1H3,(H,10,11)
InChI Key:
YXDWZCAMTKGVSY-UHFFFAOYSA-N
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.95g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
303.059g/mol
Monoisotopic Mass:
302.95g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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