tert-butyl-dimethyl-[[(8Z)-2-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,8,10(14),11,15-heptaenyl]oxy]silane

C22H28OSi — CID 10871421

IUPACtert-butyl-dimethyl-[[(8Z)-2-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,8,10(14),11,15-heptaenyl]oxy]silane
SMILESCC(C)(C)[Si](C)(C)OC1Cc2ccc(cc2)/C=C\c2ccc1cc2
InChIInChI=1S/C22H28OSi/c1-22(2,3)24(4,5)23-21-16-19-10-8-17(9-11-19)6-7-18-12-14-20(21)15-13-18/h6-15,21H,16H2,1-5H3/b7-6-
InChIKeyGUAPAEVODHGGJV-SREVYHEPSA-N
MW336.55 g/mol
LogP6.48
Rot. Bonds2

About tert-butyl-dimethyl-[[(8Z)-2-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,8,10(14),11,15-heptaenyl]oxy]silane

tert-butyl-dimethyl-[[(8Z)-2-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,8,10(14),11,15-heptaenyl]oxy]silane (PubChem CID 10871421) has the molecular formula C22H28OSi and a molecular weight of 336.55 g/mol. Its IUPAC name is tert-butyl-dimethyl-[[(8Z)-2-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,8,10(14),11,15-heptaenyl]oxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[[(8Z)-2-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,8,10(14),11,15-heptaenyl]oxy]silane
PubChem CID10871421
Molecular FormulaC22H28OSi
Molecular Weight336.55 g/mol
Exact Mass336.19
IUPAC Nametert-butyl-dimethyl-[[(8Z)-2-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,8,10(14),11,15-heptaenyl]oxy]silane
SMILESCC(C)(C)[Si](C)(C)OC1Cc2ccc(cc2)/C=C\c2ccc1cc2
InChIInChI=1S/C22H28OSi/c1-22(2,3)24(4,5)23-21-16-19-10-8-17(9-11-19)6-7-18-12-14-20(21)15-13-18/h6-15,21H,16H2,1-5H3/b7-6-
InChIKeyGUAPAEVODHGGJV-SREVYHEPSA-N
XLogP6.48
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.55
LogP ≤ 56.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze tert-butyl-dimethyl-[[(8Z)-2-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,8,10(14),11,15-heptaenyl]oxy]silane with MolForge

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Related Compounds

4-Methylbenzhydrol
CID 95377
4,4'-Dimethylbenzhydrol
CID 279356
Benzyloxytrimethylsilane
CID 518982
4-(Methoxy-phenyl-methyl)-biphenyl
CID 4408101
Bis(4-(tert-butyl)phenyl)methanol
CID 357627
Silane, (2-chloroethyl)methylbis(phenylmethoxy)-
CID 94518
{2-[Dimethyl(2-methylphenyl)silyl]phenyl}methanol
CID 11989422
Silane, triethyl(phenylmethoxy)-
CID 563229
Silane, trimethyl(1-phenylethoxy)-
CID 519015
1,2-Ethanediol, phenyl, bis-TMS
CID 530367
1-Propanol, 1-phenyl, TMS
CID 530376
Silane, (1,1-dimethylethyl)dimethyl(phenylmethoxy)-
CID 596642

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[[(8Z)-2-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,8,10(14),11,15-heptaenyl]oxy]silane?
The IUPAC name of tert-butyl-dimethyl-[[(8Z)-2-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,8,10(14),11,15-heptaenyl]oxy]silane (CID 10871421) is tert-butyl-dimethyl-[[(8Z)-2-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,8,10(14),11,15-heptaenyl]oxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[[(8Z)-2-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,8,10(14),11,15-heptaenyl]oxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[[(8Z)-2-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,8,10(14),11,15-heptaenyl]oxy]silane is CC(C)(C)[Si](C)(C)OC1Cc2ccc(cc2)/C=C\c2ccc1cc2.
What is the InChIKey of tert-butyl-dimethyl-[[(8Z)-2-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,8,10(14),11,15-heptaenyl]oxy]silane?
The InChIKey is GUAPAEVODHGGJV-SREVYHEPSA-N. The full InChI is InChI=1S/C22H28OSi/c1-22(2,3)24(4,5)23-21-16-19-10-8-17(9-11-19)6-7-18-12-14-20(21)15-13-18/h6-15,21H,16H2,1-5H3/b7-6-.
What are the key properties of tert-butyl-dimethyl-[[(8Z)-2-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,8,10(14),11,15-heptaenyl]oxy]silane?
tert-butyl-dimethyl-[[(8Z)-2-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,8,10(14),11,15-heptaenyl]oxy]silane has a molecular weight of 336.55 g/mol, XLogP of 6.48, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[[(8Z)-2-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,8,10(14),11,15-heptaenyl]oxy]silane is sourced from PubChem (CID 10871421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).