CID 66773398

C32H30O4Si2 — CID 66773398

IUPAC—
SMILESO=C(O[Si]CCCC[Si]OC(=O)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C32H30O4Si2/c33-31(29(25-15-5-1-6-16-25)26-17-7-2-8-18-26)35-37-23-13-14-24-38-36-32(34)30(27-19-9-3-10-20-27)28-21-11-4-12-22-28/h1-12,15-22,29-30H,13-14,23-24H2
InChIKeyCJGRUWZXQNOJGY-UHFFFAOYSA-N
MW534.76 g/mol
LogP6.59
Rot. Bonds13

About CID 66773398

CID 66773398 (PubChem CID 66773398) has the molecular formula C32H30O4Si2 and a molecular weight of 534.76 g/mol.

Molecular Properties

Compound NameCID 66773398
PubChem CID66773398
Molecular FormulaC32H30O4Si2
Molecular Weight534.76 g/mol
Exact Mass534.17
IUPAC Name—
SMILESO=C(O[Si]CCCC[Si]OC(=O)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C32H30O4Si2/c33-31(29(25-15-5-1-6-16-25)26-17-7-2-8-18-26)35-37-23-13-14-24-38-36-32(34)30(27-19-9-3-10-20-27)28-21-11-4-12-22-28/h1-12,15-22,29-30H,13-14,23-24H2
InChIKeyCJGRUWZXQNOJGY-UHFFFAOYSA-N
XLogP6.59
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500534.76
LogP ≤ 56.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2,2-diphenylacetyl)oxymethyl 2,2-diphenylacetate
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tris[(2,2-diphenylacetyl)oxy]stannyl 2,2-diphenylacetate
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phenacyl 2,2-diphenylacetate
CID 597416
2-methylprop-2-enyl 2,2-diphenylacetate
CID 135086240
[(1R)-1-phenylethyl] 2,2-diphenylacetate
CID 11001611
1,1,5,5-tetraphenylpentane-2,4-dione
CID 22951899
2-(2,2-diphenylacetyl)oxyethyl-dimethylazanium
CID 3553500
(2,2-diphenylacetyl) 2,2,2-trifluoroacetate
CID 90806086
[(2R)-2-methoxy-2-phenylethyl] [(2S)-2-methoxy-2-phenylethyl] carbonate
CID 102443903
methyl (2R)-2-(4-methylphenyl)-2-phenylacetate
CID 54311643
(2-oxo-1,2-diphenylethyl) 2,2-diphenylacetate
CID 2935756
(2,5-dihydroxypyrrol-1-yl) 2,2-diphenylacetate
CID 123604144

Frequently Asked Questions

What is the IUPAC name of CID 66773398?
The IUPAC name of CID 66773398 (CID 66773398) is not available.
What is the SMILES notation for CID 66773398?
The canonical SMILES for CID 66773398 is O=C(O[Si]CCCC[Si]OC(=O)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of CID 66773398?
The InChIKey is CJGRUWZXQNOJGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H30O4Si2/c33-31(29(25-15-5-1-6-16-25)26-17-7-2-8-18-26)35-37-23-13-14-24-38-36-32(34)30(27-19-9-3-10-20-27)28-21-11-4-12-22-28/h1-12,15-22,29-30H,13-14,23-24H2.
What are the key properties of CID 66773398?
CID 66773398 has a molecular weight of 534.76 g/mol, XLogP of 6.59, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 66773398 is sourced from PubChem (CID 66773398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).