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885520-96-7 | 4-CYANO-3-IODO-6-METHYLINDAZOLE
CAS No: 885520-96-7 Catalog No: AG00GZY6 MDL No:
Product Description
Catalog Number:
AG00GZY6
Chemical Name:
4-CYANO-3-IODO-6-METHYLINDAZOLE
CAS Number:
885520-96-7
IUPAC Name:
3-iodo-6-methyl-2H-indazole-4-carbonitrile
InChI:
InChI=1S/C9H6IN3/c1-5-2-6(4-11)8-7(3-5)12-13-9(8)10/h2-3H,1H3,(H,12,13)
InChI Key:
ZNTWEIDFXHMQFU-UHFFFAOYSA-N
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.961g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
283.072g/mol
Monoisotopic Mass:
282.961g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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