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Home > Nitro Compounds > 88631-45-2
88631-45-2 | Butanenitrile, 2-methyl-3-nitro-2-[(trimethylsilyl)oxy]-
CAS No: 88631-45-2 Catalog No: AG004BPY MDL No:
Product Description
Catalog Number:
AG004BPY
Chemical Name:
Butanenitrile, 2-methyl-3-nitro-2-[(trimethylsilyl)oxy]-
CAS Number:
88631-45-2
Molecular Formula:
C8H16N2O3Si
Molecular Weight:
216.3097
IUPAC Name:
2-methyl-3-nitro-2-trimethylsilyloxybutanenitrile
InChI:
InChI=1S/C8H16N2O3Si/c1-7(10(11)12)8(2,6-9)13-14(3,4)5/h7H,1-5H3
InChI Key:
HCHFOZJFMNLQSI-UHFFFAOYSA-N
SMILES:
CC(C(O[Si](C)(C)C)(C#N)C)[N+](=O)[O-]
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.093g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.312g/mol
Monoisotopic Mass:
216.093g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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