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1254473-78-3 | 5-((tert-butyldimethylsilyl)oxy)-3-iodo-1-(tetrahydro-2H-pyran-2-yl)-1H-indazole
CAS No: 1254473-78-3 Catalog No: AG01DGMV MDL No:MFCD17170302
Product Description
Catalog Number:
AG01DGMV
Chemical Name:
5-((tert-butyldimethylsilyl)oxy)-3-iodo-1-(tetrahydro-2H-pyran-2-yl)-1H-indazole
CAS Number:
1254473-78-3
Molecular Formula:
C18H27IN2O2Si
Molecular Weight:
458.4091
MDL Number:
MFCD17170302
IUPAC Name:
tert-butyl-[3-iodo-1-(oxan-2-yl)indazol-5-yl]oxy-dimethylsilane
InChI:
InChI=1S/C18H27IN2O2Si/c1-18(2,3)24(4,5)23-13-9-10-15-14(12-13)17(19)20-21(15)16-8-6-7-11-22-16/h9-10,12,16H,6-8,11H2,1-5H3
InChI Key:
DLOWRBHQNGAXOO-UHFFFAOYSA-N
SMILES:
Ic1nn(c2c1cc(cc2)O[Si](C(C)(C)C)(C)C)C1CCCCO1
Properties
Complexity:
443
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
458.089g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
458.415g/mol
Monoisotopic Mass:
458.089g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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