CID 157267802

C16H44Ge2O8 — CID 157267802

IUPAC—
SMILESCCCCO[Ge](CCOCC)(OCCCC)OCCCC.O.O.O.O.[Ge]
InChIInChI=1S/C16H36GeO4.Ge.4H2O/c1-5-9-13-19-17(12-16-18-8-4,20-14-10-6-2)21-15-11-7-3;;;;;/h5-16H2,1-4H3;;4*1H2
InChIKeyMQLBCAPHQORVQG-UHFFFAOYSA-N
MW509.74 g/mol
LogP0.73
Rot. Bonds16

About CID 157267802

CID 157267802 (PubChem CID 157267802) has the molecular formula C16H44Ge2O8 and a molecular weight of 509.74 g/mol.

Molecular Properties

Compound NameCID 157267802
PubChem CID157267802
Molecular FormulaC16H44Ge2O8
Molecular Weight509.74 g/mol
Exact Mass512.15
IUPAC Name—
SMILESCCCCO[Ge](CCOCC)(OCCCC)OCCCC.O.O.O.O.[Ge]
InChIInChI=1S/C16H36GeO4.Ge.4H2O/c1-5-9-13-19-17(12-16-18-8-4,20-14-10-6-2)21-15-11-7-3;;;;;/h5-16H2,1-4H3;;4*1H2
InChIKeyMQLBCAPHQORVQG-UHFFFAOYSA-N
XLogP0.73
TPSA162.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds16
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500509.74
LogP ≤ 50.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

tributoxy(2-ethoxyethyl)germane
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ethane;1-ethoxybutane
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ethane;1-ethoxybutane;molecular hydrogen
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1-(3-ethoxypropylperoxy)butane
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ethane-1,2-diol;1-ethoxybutane
CID 23504299
tribromo(butoxy)germane
CID 22477053
tributoxy(chloro)germane
CID 22476945
bis(1-ethoxy-2-methoxyethane);hydrate
CID 88797439
1-butoxybutane;1-ethoxy-2-(2-ethoxyethoxy)ethane;2-(2-hydroxyethoxy)ethanol
CID 118657939
1-[2-(2-ethoxyethoxy)ethenoxy]butane
CID 73415368
ethane-1,2-diol;ethoxyethane;1-methoxybutane
CID 87456565
1-(3-ethoxypropoxy)tetradecane
CID 91693148

Frequently Asked Questions

What is the IUPAC name of CID 157267802?
The IUPAC name of CID 157267802 (CID 157267802) is not available.
What is the SMILES notation for CID 157267802?
The canonical SMILES for CID 157267802 is CCCCO[Ge](CCOCC)(OCCCC)OCCCC.O.O.O.O.[Ge].
What is the InChIKey of CID 157267802?
The InChIKey is MQLBCAPHQORVQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36GeO4.Ge.4H2O/c1-5-9-13-19-17(12-16-18-8-4,20-14-10-6-2)21-15-11-7-3;;;;;/h5-16H2,1-4H3;;4*1H2.
What are the key properties of CID 157267802?
CID 157267802 has a molecular weight of 509.74 g/mol, XLogP of 0.73, 16 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 157267802 is sourced from PubChem (CID 157267802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).