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83867-52-1 | 2,8,9-Trioxa-5-aza-1-silabicyclo[3.3.3]undecane, 1-(3-bromophenyl)-
CAS No: 83867-52-1 Catalog No: AG004RUM MDL No:
Product Description
Catalog Number:
AG004RUM
Chemical Name:
2,8,9-Trioxa-5-aza-1-silabicyclo[3.3.3]undecane, 1-(3-bromophenyl)-
CAS Number:
83867-52-1
Molecular Formula:
C12H16BrNO3Si
Molecular Weight:
330.2498
IUPAC Name:
1-(3-bromophenyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane
InChI:
InChI=1S/C12H16BrNO3Si/c13-11-2-1-3-12(10-11)18-15-7-4-14(5-8-16-18)6-9-17-18/h1-3,10H,4-9H2
InChI Key:
MUGWLQXRWXYNFK-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)[Si]12OCCN(CCO1)CCO2
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.008g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
330.253g/mol
Monoisotopic Mass:
329.008g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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