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319472-83-8 | 1H-Indazole, 3-iodo-6-nitro-1-[[2-(trimethylsilyl)ethoxy]methyl]-
CAS No: 319472-83-8 Catalog No: AG007I4D MDL No:
Product Description
Catalog Number:
AG007I4D
Chemical Name:
1H-Indazole, 3-iodo-6-nitro-1-[[2-(trimethylsilyl)ethoxy]methyl]-
CAS Number:
319472-83-8
Molecular Formula:
C13H18IN3O3Si
Molecular Weight:
419.2903
IUPAC Name:
2-[(3-iodo-6-nitroindazol-1-yl)methoxy]ethyl-trimethylsilane
InChI:
InChI=1S/C13H18IN3O3Si/c1-21(2,3)7-6-20-9-16-12-8-10(17(18)19)4-5-11(12)13(14)15-16/h4-5,8H,6-7,9H2,1-3H3
InChI Key:
QBMKTNPVTMKYFL-UHFFFAOYSA-N
SMILES:
Ic1nn(c2c1ccc(c2)[N+](=O)[O-])COCC[Si](C)(C)C
Properties
Complexity:
375
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
419.016g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
419.294g/mol
Monoisotopic Mass:
419.016g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
72.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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