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887570-61-8 | 3,6-DIIODO-4-METHOXY (1H)INDAZOLE
CAS No: 887570-61-8 Catalog No: AG00GZT9 MDL No:
Product Description
Catalog Number:
AG00GZT9
Chemical Name:
3,6-DIIODO-4-METHOXY (1H)INDAZOLE
CAS Number:
887570-61-8
IUPAC Name:
3,6-diiodo-4-methoxy-2H-indazole
InChI:
InChI=1S/C8H6I2N2O/c1-13-6-3-4(9)2-5-7(6)8(10)12-11-5/h2-3H,1H3,(H,11,12)
InChI Key:
PEVNQNJJXNKTAH-UHFFFAOYSA-N
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
399.857g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
399.958g/mol
Monoisotopic Mass:
399.857g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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