5-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;6-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;9-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;10-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole

C132H96Si4 — CID 159345629

IUPAC5-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;6-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;9-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;10-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole
SMILESCc1c2ccccc2cc2c3c(ccc12)-c1ccccc1[Si]3(c1ccccc1)c1ccccc1.Cc1cc2c(c3cc4ccccc4cc13)[Si](c1ccccc1)(c1ccccc1)c1ccccc1-2.Cc1ccc2c(c1)-c1ccc3cc4ccccc4cc3c1[Si]2(c1ccccc1)c1ccccc1.Cc1ccc2c(c1)[Si](c1ccccc1)(c1ccccc1)c1c-2ccc2cc3ccccc3cc12
InChIInChI=1S/4C33H24Si/c1-23-20-30-28-18-10-11-19-32(28)34(26-14-4-2-5-15-26,27-16-6-3-7-17-27)33(30)31-22-25-13-9-8-12-24(25)21-29(23)31;1-23-27-17-9-8-12-24(27)22-31-28(23)20-21-30-29-18-10-11-19-32(29)34(33(30)31,25-13-4-2-5-14-25)26-15-6-3-7-16-26;1-23-16-19-32-31(20-23)29-18-17-26-21-24-10-8-9-11-25(24)22-30(26)33(29)34(32,27-12-4-2-5-13-27)28-14-6-3-7-15-28;1-23-16-18-29-30-19-17-26-21-24-10-8-9-11-25(24)22-31(26)33(30)34(32(29)20-23,27-12-4-2-5-13-27)28-14-6-3-7-15-28/h4*2-22H,1H3
InChIKeyLGRNRDACFZAQBM-UHFFFAOYSA-N
MW1794.56 g/mol
LogP22.64
Rot. Bonds8

About 5-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;6-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;9-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;10-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole

5-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;6-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;9-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;10-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole (PubChem CID 159345629) has the molecular formula C132H96Si4 and a molecular weight of 1794.56 g/mol. Its IUPAC name is 5-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;6-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;9-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;10-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole.

Molecular Properties

Compound Name5-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;6-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;9-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;10-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole
PubChem CID159345629
Molecular FormulaC132H96Si4
Molecular Weight1794.56 g/mol
Exact Mass1792.66
IUPAC Name5-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;6-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;9-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;10-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole
SMILESCc1c2ccccc2cc2c3c(ccc12)-c1ccccc1[Si]3(c1ccccc1)c1ccccc1.Cc1cc2c(c3cc4ccccc4cc13)[Si](c1ccccc1)(c1ccccc1)c1ccccc1-2.Cc1ccc2c(c1)-c1ccc3cc4ccccc4cc3c1[Si]2(c1ccccc1)c1ccccc1.Cc1ccc2c(c1)[Si](c1ccccc1)(c1ccccc1)c1c-2ccc2cc3ccccc3cc12
InChIInChI=1S/4C33H24Si/c1-23-20-30-28-18-10-11-19-32(28)34(26-14-4-2-5-15-26,27-16-6-3-7-17-27)33(30)31-22-25-13-9-8-12-24(25)21-29(23)31;1-23-27-17-9-8-12-24(27)22-31-28(23)20-21-30-29-18-10-11-19-32(29)34(33(30)31,25-13-4-2-5-14-25)26-15-6-3-7-16-26;1-23-16-19-32-31(20-23)29-18-17-26-21-24-10-8-9-11-25(24)22-30(26)33(29)34(32,27-12-4-2-5-13-27)28-14-6-3-7-15-28;1-23-16-18-29-30-19-17-26-21-24-10-8-9-11-25(24)22-31(26)33(30)34(32(29)20-23,27-12-4-2-5-13-27)28-14-6-3-7-15-28/h4*2-22H,1H3
InChIKeyLGRNRDACFZAQBM-UHFFFAOYSA-N
XLogP22.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms136
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001794.56
LogP ≤ 522.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 5-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;6-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;9-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;10-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole with MolForge

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Related Compounds

9-methyl-11,11-diphenylphenanthro[1,2-b][1]benzosilole
CID 153488459
2-methyl-5,5-diphenylanthra[2,1-b][1]benzosilole
CID 153488401
dodecakis(2,2-dimethylpropane);5,5-diphenylbenzo[b][1]benzosilole;5,5-diphenylnaphtho[2,3-b][1]benzosilole;7,7-diphenylnaphtho[2,1-b][1]benzosilole;11,11-diphenylnaphtho[1,2-b][1]benzosilole;12,12-diphenyl-12-silapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12,12-diphenyl-12-silapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene
CID 165065368
5-(4-methylphenyl)-5-phenylnaphtho[2,3-b][1]benzosilole
CID 153488427
18-methyl-10,10-diphenyl-10-silapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene
CID 153488342
5-(3-methylphenyl)-5-phenylanthra[2,1-b][1]benzosilole
CID 153488378
3,7-dimethyl-5,5-diphenylbenzo[b][1]benzosilole
CID 59167435
7-methyl-5,5-diphenylanthra[2,1-b][1]benzosilole
CID 153488362
6-methyl-12,12-diphenyl-12-silapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3(8),4,6,9,13,15,17,19-decaene
CID 153488316
5-methyl-9,9-diphenyl-9-silapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3(8),4,6,11,14,16,18,20-decaene;17-methyl-9,9-diphenyl-9-silapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;18-methyl-9,9-diphenyl-9-silapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16(21),17,19-decaene;19-methyl-9,9-diphenyl-9-silapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16(21),17,19-decaene
CID 159334909
5,14-dimethyl-8,8-diphenyl-8-silatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene
CID 176637820
2,6-dimethylanthracene;bis(2,9-dimethylanthracene);bis(2,10-dimethylanthracene)
CID 159448602

Frequently Asked Questions

What is the IUPAC name of 5-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;6-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;9-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;10-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole?
The IUPAC name of 5-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;6-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;9-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;10-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole (CID 159345629) is 5-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;6-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;9-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;10-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole.
What is the SMILES notation for 5-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;6-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;9-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;10-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole?
The canonical SMILES for 5-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;6-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;9-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;10-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole is Cc1c2ccccc2cc2c3c(ccc12)-c1ccccc1[Si]3(c1ccccc1)c1ccccc1.Cc1cc2c(c3cc4ccccc4cc13)[Si](c1ccccc1)(c1ccccc1)c1ccccc1-2.Cc1ccc2c(c1)-c1ccc3cc4ccccc4cc3c1[Si]2(c1ccccc1)c1ccccc1.Cc1ccc2c(c1)[Si](c1ccccc1)(c1ccccc1)c1c-2ccc2cc3ccccc3cc12.
What is the InChIKey of 5-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;6-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;9-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;10-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole?
The InChIKey is LGRNRDACFZAQBM-UHFFFAOYSA-N. The full InChI is InChI=1S/4C33H24Si/c1-23-20-30-28-18-10-11-19-32(28)34(26-14-4-2-5-15-26,27-16-6-3-7-17-27)33(30)31-22-25-13-9-8-12-24(25)21-29(23)31;1-23-27-17-9-8-12-24(27)22-31-28(23)20-21-30-29-18-10-11-19-32(29)34(33(30)31,25-13-4-2-5-14-25)26-15-6-3-7-16-26;1-23-16-19-32-31(20-23)29-18-17-26-21-24-10-8-9-11-25(24)22-30(26)33(29)34(32,27-12-4-2-5-13-27)28-14-6-3-7-15-28;1-23-16-18-29-30-19-17-26-21-24-10-8-9-11-25(24)22-31(26)33(30)34(32(29)20-23,27-12-4-2-5-13-27)28-14-6-3-7-15-28/h4*2-22H,1H3.
What are the key properties of 5-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;6-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;9-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;10-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole?
5-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;6-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;9-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;10-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole has a molecular weight of 1794.56 g/mol, XLogP of 22.64, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;6-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;9-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole;10-methyl-12,12-diphenylanthra[1,2-b][1]benzosilole is sourced from PubChem (CID 159345629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).