(3,5-dimethoxyphenyl)-[(3,5-dimethoxyphenyl)-phenylsilyl]oxy-phenylsilane

C28H30O5Si2 — CID 123384714

IUPAC(3,5-dimethoxyphenyl)-[(3,5-dimethoxyphenyl)-phenylsilyl]oxy-phenylsilane
SMILESCOc1cc(OC)cc([SiH](O[SiH](c2ccccc2)c2cc(OC)cc(OC)c2)c2ccccc2)c1
InChIInChI=1S/C28H30O5Si2/c1-29-21-15-22(30-2)18-27(17-21)34(25-11-7-5-8-12-25)33-35(26-13-9-6-10-14-26)28-19-23(31-3)16-24(20-28)32-4/h5-20,34-35H,1-4H3
InChIKeySXAVFJFQCICZBP-UHFFFAOYSA-N
MW502.72 g/mol
LogP2.11
Rot. Bonds10

About (3,5-dimethoxyphenyl)-[(3,5-dimethoxyphenyl)-phenylsilyl]oxy-phenylsilane

(3,5-dimethoxyphenyl)-[(3,5-dimethoxyphenyl)-phenylsilyl]oxy-phenylsilane (PubChem CID 123384714) has the molecular formula C28H30O5Si2 and a molecular weight of 502.72 g/mol. Its IUPAC name is (3,5-dimethoxyphenyl)-[(3,5-dimethoxyphenyl)-phenylsilyl]oxy-phenylsilane.

Molecular Properties

Compound Name(3,5-dimethoxyphenyl)-[(3,5-dimethoxyphenyl)-phenylsilyl]oxy-phenylsilane
PubChem CID123384714
Molecular FormulaC28H30O5Si2
Molecular Weight502.72 g/mol
Exact Mass502.16
IUPAC Name(3,5-dimethoxyphenyl)-[(3,5-dimethoxyphenyl)-phenylsilyl]oxy-phenylsilane
SMILESCOc1cc(OC)cc([SiH](O[SiH](c2ccccc2)c2cc(OC)cc(OC)c2)c2ccccc2)c1
InChIInChI=1S/C28H30O5Si2/c1-29-21-15-22(30-2)18-27(17-21)34(25-11-7-5-8-12-25)33-35(26-13-9-6-10-14-26)28-19-23(31-3)16-24(20-28)32-4/h5-20,34-35H,1-4H3
InChIKeySXAVFJFQCICZBP-UHFFFAOYSA-N
XLogP2.11
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500502.72
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1,3-dimethoxy-5-phenylbenzene
CID 11469945
1,4-bis(3,5-dimethoxyphenyl)-2,3,5,6-tetraphenylbenzene
CID 102293642
phosphane;1,3,5-trimethoxybenzene
CID 175232895
1,3-dimethoxy-5-phenylsulfanylbenzene
CID 122365183
CID 174807806
CID 174807806
anisole;trihydrofluoride
CID 174796385
CID 172685187
CID 172685187
anisole;hydrochloride
CID 158800007
diphenylsilylperoxy(diphenyl)silane;trimethylsilane
CID 123626181
1-[2-[2-[2-(3,5-dimethoxyphenyl)ethynyl]phenyl]ethynyl]-3,5-dimethoxybenzene
CID 170457008
(3,5-dimethoxyphenyl)phosphanium;tetraphenylboranuide
CID 175358048
CID 172849383
CID 172849383

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethoxyphenyl)-[(3,5-dimethoxyphenyl)-phenylsilyl]oxy-phenylsilane?
The IUPAC name of (3,5-dimethoxyphenyl)-[(3,5-dimethoxyphenyl)-phenylsilyl]oxy-phenylsilane (CID 123384714) is (3,5-dimethoxyphenyl)-[(3,5-dimethoxyphenyl)-phenylsilyl]oxy-phenylsilane.
What is the SMILES notation for (3,5-dimethoxyphenyl)-[(3,5-dimethoxyphenyl)-phenylsilyl]oxy-phenylsilane?
The canonical SMILES for (3,5-dimethoxyphenyl)-[(3,5-dimethoxyphenyl)-phenylsilyl]oxy-phenylsilane is COc1cc(OC)cc([SiH](O[SiH](c2ccccc2)c2cc(OC)cc(OC)c2)c2ccccc2)c1.
What is the InChIKey of (3,5-dimethoxyphenyl)-[(3,5-dimethoxyphenyl)-phenylsilyl]oxy-phenylsilane?
The InChIKey is SXAVFJFQCICZBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H30O5Si2/c1-29-21-15-22(30-2)18-27(17-21)34(25-11-7-5-8-12-25)33-35(26-13-9-6-10-14-26)28-19-23(31-3)16-24(20-28)32-4/h5-20,34-35H,1-4H3.
What are the key properties of (3,5-dimethoxyphenyl)-[(3,5-dimethoxyphenyl)-phenylsilyl]oxy-phenylsilane?
(3,5-dimethoxyphenyl)-[(3,5-dimethoxyphenyl)-phenylsilyl]oxy-phenylsilane has a molecular weight of 502.72 g/mol, XLogP of 2.11, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethoxyphenyl)-[(3,5-dimethoxyphenyl)-phenylsilyl]oxy-phenylsilane is sourced from PubChem (CID 123384714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).