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854632-98-7 | 5-(benzyloxy)-3-iodo-1H-indazole
CAS No: 854632-98-7 Catalog No: AG00GM15 MDL No:
Product Description
Catalog Number:
AG00GM15
Chemical Name:
5-(benzyloxy)-3-iodo-1H-indazole
CAS Number:
854632-98-7
IUPAC Name:
3-iodo-5-phenylmethoxy-2H-indazole
InChI:
InChI=1S/C14H11IN2O/c15-14-12-8-11(6-7-13(12)16-17-14)18-9-10-4-2-1-3-5-10/h1-8H,9H2,(H,16,17)
InChI Key:
SKKMIHDCBIUHRL-UHFFFAOYSA-N
Properties
Complexity:
271
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.992g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
350.159g/mol
Monoisotopic Mass:
349.992g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
37.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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