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175649-09-9 | Azulene, 1,1'-(dimethylsilylene)bis[1,4-dihydro-2-methyl-4-phenyl-
CAS No: 175649-09-9 Catalog No: AG00213B MDL No:
Product Description
Catalog Number:
AG00213B
Chemical Name:
Azulene, 1,1'-(dimethylsilylene)bis[1,4-dihydro-2-methyl-4-phenyl-
CAS Number:
175649-09-9
Molecular Formula:
C36H36Si
Molecular Weight:
496.7565
IUPAC Name:
dimethyl-bis(2-methyl-4-phenyl-1,4-dihydroazulen-1-yl)silane
InChI:
InChI=1S/C36H36Si/c1-25-23-33-29(27-15-7-5-8-16-27)19-11-13-21-31(33)35(25)37(3,4)36-26(2)24-34-30(20-12-14-22-32(34)36)28-17-9-6-10-18-28/h5-24,29-30,35-36H,1-4H3
InChI Key:
UECNDDBWURAGCU-UHFFFAOYSA-N
SMILES:
CC1=CC2=C(C1[Si](C1C(=CC3=C1C=CC=CC3c1ccccc1)C)(C)C)C=CC=CC2c1ccccc1
Properties
Complexity:
1060
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
496.259g/mol
Formal Charge:
0
Heavy Atom Count:
37
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
496.769g/mol
Monoisotopic Mass:
496.259g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
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