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4,10-dibromo-7,7-bis(2-ethylhexyl)-3,11-dithia-7-silatricyclo[6.3.0.0²,?]undeca-1(8),2(6),4,9-tetraene

4,10-dibromo-7,7-bis(2-ethylhexyl)-3,11-dithia-7-silatricyclo[6.3.0.0²,?]undeca-1(8),2(6),4,9-tetraene

CAS: 1089687-05-7

Formula: C24H36Br2S2Si

SMILES: CCCCC(CC)C[Si]1(CC(CC)CCCC)C2=C(SC(Br)=C2)C2=C1C=C(Br)S2

IUPAC: 4,10-dibromo-7,7-bis(2-ethylhexyl)-3,11-dithia-7-silatricyclo[6.3.0.0²,?]undeca-1(8),2(6),4,9-tetraene

InChI: InChI=1/C24H36Br2S2Si/c1-5-9-11-17(7-3)15-29(16-18(8-4)12-10-6-2)19-13-21(25)27-23(19)24-20(29)14-22(26)28-24/h13-14,17-18H,5-12,15-16H2,1-4H3

Composition: C (50.00%), H (6.29%), Br (27.72%), S (11.12%), Si (4.87%)

Molar Mass: 576.57

Atom Count: 65

Heavy Atom Count: 29

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 2
Exact Mass 574.039446
Formal Charge 0
FSP3 0.67
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey CMMVJTQAECTXDZ-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity 132.86
Topological Polar Surface Area 0
Polarizability 55.76
Ring Count 3
Rotatable Bond Count 12

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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 1089687-05-7 $42.87-$200.50$42.87$65.57$200.50
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