CID 154634937

C20H30OSi — CID 154634937

IUPAC—
SMILESCC(C)=CCC/C(C)=C/COCCCC[Si]c1ccccc1
InChIInChI=1S/C20H30OSi/c1-18(2)10-9-11-19(3)14-16-21-15-7-8-17-22-20-12-5-4-6-13-20/h4-6,10,12-14H,7-9,11,15-17H2,1-3H3/b19-14+
InChIKeyOXOAMVJHSUQIIH-XMHGGMMESA-N
MW314.55 g/mol
LogP4.92
Rot. Bonds11

About CID 154634937

CID 154634937 (PubChem CID 154634937) has the molecular formula C20H30OSi and a molecular weight of 314.55 g/mol.

Molecular Properties

Compound NameCID 154634937
PubChem CID154634937
Molecular FormulaC20H30OSi
Molecular Weight314.55 g/mol
Exact Mass314.21
IUPAC Name—
SMILESCC(C)=CCC/C(C)=C/COCCCC[Si]c1ccccc1
InChIInChI=1S/C20H30OSi/c1-18(2)10-9-11-19(3)14-16-21-15-7-8-17-22-20-12-5-4-6-13-20/h4-6,10,12-14H,7-9,11,15-17H2,1-3H3/b19-14+
InChIKeyOXOAMVJHSUQIIH-XMHGGMMESA-N
XLogP4.92
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.55
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 72752481
1-hept-6-enoxy-3,7-dimethylocta-2,6-diene
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3-[(2E)-3,7-dimethylocta-2,6-dienoxy]prop-1-en-2-ylbenzene
CID 102207934
3,7-dimethylocta-2,6-dienyl 2-oxo-2-phenylacetate
CID 140658272
3,7,11-trimethyldodeca-2,6,10-trienoxymethanol
CID 173478394
2-[(2E)-3,7-dimethylocta-2,6-dienoxy]acetic acid
CID 12648855
(2E,6E,10E)-2,6,10-trimethyl-12-phenylmethoxydodeca-2,6,10-trien-1-ol
CID 11163277
(2E)-3,7-dimethylocta-2,6-dien-1-ol;2-methoxyphenol
CID 174793032
1-(methoxymethoxy)-3,7-dimethylocta-2,6-diene
CID 3018010
[(2Z)-3,7-dimethylocta-2,6-dienyl] (E)-3-phenylprop-2-enoate
CID 22035471
[(2E)-3,7-dimethyl-1-phenoxyocta-2,6-dienoxy]benzene
CID 70357331
[(2Z,6Z)-8-bromo-3,7-dimethylocta-2,6-dienoxy]methylbenzene
CID 102293653

Frequently Asked Questions

What is the IUPAC name of CID 154634937?
The IUPAC name of CID 154634937 (CID 154634937) is not available.
What is the SMILES notation for CID 154634937?
The canonical SMILES for CID 154634937 is CC(C)=CCC/C(C)=C/COCCCC[Si]c1ccccc1.
What is the InChIKey of CID 154634937?
The InChIKey is OXOAMVJHSUQIIH-XMHGGMMESA-N. The full InChI is InChI=1S/C20H30OSi/c1-18(2)10-9-11-19(3)14-16-21-15-7-8-17-22-20-12-5-4-6-13-20/h4-6,10,12-14H,7-9,11,15-17H2,1-3H3/b19-14+.
What are the key properties of CID 154634937?
CID 154634937 has a molecular weight of 314.55 g/mol, XLogP of 4.92, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 154634937 is sourced from PubChem (CID 154634937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).