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1003858-63-6 | Benzenamine, 5-methyl-4-nitro-2-[2-(trimethylsilyl)ethynyl]-
CAS No: 1003858-63-6 Catalog No: AG0001UT MDL No:
Product Description
Catalog Number:
AG0001UT
Chemical Name:
Benzenamine, 5-methyl-4-nitro-2-[2-(trimethylsilyl)ethynyl]-
CAS Number:
1003858-63-6
Molecular Formula:
C12H16N2O2Si
Molecular Weight:
248.3531
IUPAC Name:
5-methyl-4-nitro-2-(2-trimethylsilylethynyl)aniline
InChI:
InChI=1S/C12H16N2O2Si/c1-9-7-11(13)10(5-6-17(2,3)4)8-12(9)14(15)16/h7-8H,13H2,1-4H3
InChI Key:
YZTDWZCGZWORTO-UHFFFAOYSA-N
SMILES:
Nc1cc(C)c(cc1C#C[Si](C)(C)C)[N+](=O)[O-]
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.098g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.357g/mol
Monoisotopic Mass:
248.098g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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