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189619-30-5 | 1,2-Ethanedione, 1,2-bis[4-[2-[tris(1-methylethyl)silyl]ethynyl]phenyl]-
CAS No: 189619-30-5 Catalog No: AG002DSU MDL No:
Product Description
Catalog Number:
AG002DSU
Chemical Name:
1,2-Ethanedione, 1,2-bis[4-[2-[tris(1-methylethyl)silyl]ethynyl]phenyl]-
CAS Number:
189619-30-5
Molecular Formula:
C36H50O2Si2
Molecular Weight:
570.9520
IUPAC Name:
1,2-bis[4-[2-tri(propan-2-yl)silylethynyl]phenyl]ethane-1,2-dione
InChI:
InChI=1S/C36H50O2Si2/c1-25(2)39(26(3)4,27(5)6)23-21-31-13-17-33(18-14-31)35(37)36(38)34-19-15-32(16-20-34)22-24-40(28(7)8,29(9)10)30(11)12/h13-20,25-30H,1-12H3
InChI Key:
MLKRAGGEZISJIP-UHFFFAOYSA-N
SMILES:
CC([Si](C(C)C)(C(C)C)C#Cc1ccc(cc1)C(=O)C(=O)c1ccc(cc1)C#C[Si](C(C)C)(C(C)C)C(C)C)C
Properties
Complexity:
865
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
570.335g/mol
Formal Charge:
0
Heavy Atom Count:
40
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
570.964g/mol
Monoisotopic Mass:
570.335g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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