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129459-88-7 | Silanediol, diphenyl-, bis(3-nitrobenzoate) (9CI)
CAS No: 129459-88-7 Catalog No: AG000Z5W MDL No:
Product Description
Catalog Number:
AG000Z5W
Chemical Name:
Silanediol, diphenyl-, bis(3-nitrobenzoate) (9CI)
CAS Number:
129459-88-7
Molecular Formula:
C26H22N2O10Si
Molecular Weight:
550.5458
IUPAC Name:
dihydroxy(diphenyl)silane;3-nitrobenzoic acid
InChI:
InChI=1S/C12H12O2Si.2C7H5NO4/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12;2*9-7(10)5-2-1-3-6(4-5)8(11)12/h1-10,13-14H;2*1-4H,(H,9,10)
InChI Key:
VZSFLVXCVVFIMO-UHFFFAOYSA-N
SMILES:
O[Si](c1ccccc1)(c1ccccc1)O.OC(=O)c1cccc(c1)[N+](=O)[O-].OC(=O)c1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
550.104g/mol
Formal Charge:
0
Heavy Atom Count:
39
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
550.551g/mol
Monoisotopic Mass:
550.104g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
207A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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