[(Z)-5,5-dimethyl-2-prop-2-enoxyhex-1-en-3-ynyl]-triethylgermane

C17H30GeO — CID 134922018

IUPAC[(Z)-5,5-dimethyl-2-prop-2-enoxyhex-1-en-3-ynyl]-triethylgermane
SMILESC=CCO/C(C#CC(C)(C)C)=C\[Ge](CC)(CC)CC
InChIInChI=1S/C17H30GeO/c1-8-14-19-16(12-13-17(5,6)7)15-18(9-2,10-3)11-4/h8,15H,1,9-11,14H2,2-7H3/b16-15-
InChIKeyFIOROACMRSTWHW-NXVVXOECSA-N
MW323.04 g/mol
LogP5.17
Rot. Bonds7

About [(Z)-5,5-dimethyl-2-prop-2-enoxyhex-1-en-3-ynyl]-triethylgermane

[(Z)-5,5-dimethyl-2-prop-2-enoxyhex-1-en-3-ynyl]-triethylgermane (PubChem CID 134922018) has the molecular formula C17H30GeO and a molecular weight of 323.04 g/mol. Its IUPAC name is [(Z)-5,5-dimethyl-2-prop-2-enoxyhex-1-en-3-ynyl]-triethylgermane.

Molecular Properties

Compound Name[(Z)-5,5-dimethyl-2-prop-2-enoxyhex-1-en-3-ynyl]-triethylgermane
PubChem CID134922018
Molecular FormulaC17H30GeO
Molecular Weight323.04 g/mol
Exact Mass324.15
IUPAC Name[(Z)-5,5-dimethyl-2-prop-2-enoxyhex-1-en-3-ynyl]-triethylgermane
SMILESC=CCO/C(C#CC(C)(C)C)=C\[Ge](CC)(CC)CC
InChIInChI=1S/C17H30GeO/c1-8-14-19-16(12-13-17(5,6)7)15-18(9-2,10-3)11-4/h8,15H,1,9-11,14H2,2-7H3/b16-15-
InChIKeyFIOROACMRSTWHW-NXVVXOECSA-N
XLogP5.17
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500323.04
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

triethyl-[(Z)-5-methoxy-2-prop-2-enoxypent-1-en-3-ynyl]germane
CID 134922041
[(Z)-5-methoxy-2-prop-2-enoxypent-1-en-3-ynyl]-trimethylgermane
CID 134922115
[(Z)-5,5-dimethyl-2-prop-2-enoxyhex-1-en-3-ynyl]-trimethylgermane
CID 134922210
5,5-Dimethyl-2-prop-2-enoxyhex-1-en-3-yne
CID 134922243
1-(6,6-Dimethylhept-2-en-4-ynoxy)-6,6-dimethylhept-2-en-4-yne
CID 140354075

Frequently Asked Questions

What is the IUPAC name of [(Z)-5,5-dimethyl-2-prop-2-enoxyhex-1-en-3-ynyl]-triethylgermane?
The IUPAC name of [(Z)-5,5-dimethyl-2-prop-2-enoxyhex-1-en-3-ynyl]-triethylgermane (CID 134922018) is [(Z)-5,5-dimethyl-2-prop-2-enoxyhex-1-en-3-ynyl]-triethylgermane.
What is the SMILES notation for [(Z)-5,5-dimethyl-2-prop-2-enoxyhex-1-en-3-ynyl]-triethylgermane?
The canonical SMILES for [(Z)-5,5-dimethyl-2-prop-2-enoxyhex-1-en-3-ynyl]-triethylgermane is C=CCO/C(C#CC(C)(C)C)=C\[Ge](CC)(CC)CC.
What is the InChIKey of [(Z)-5,5-dimethyl-2-prop-2-enoxyhex-1-en-3-ynyl]-triethylgermane?
The InChIKey is FIOROACMRSTWHW-NXVVXOECSA-N. The full InChI is InChI=1S/C17H30GeO/c1-8-14-19-16(12-13-17(5,6)7)15-18(9-2,10-3)11-4/h8,15H,1,9-11,14H2,2-7H3/b16-15-.
What are the key properties of [(Z)-5,5-dimethyl-2-prop-2-enoxyhex-1-en-3-ynyl]-triethylgermane?
[(Z)-5,5-dimethyl-2-prop-2-enoxyhex-1-en-3-ynyl]-triethylgermane has a molecular weight of 323.04 g/mol, XLogP of 5.17, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-5,5-dimethyl-2-prop-2-enoxyhex-1-en-3-ynyl]-triethylgermane is sourced from PubChem (CID 134922018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).