[(2E,5E)-3,5-dimethylhepta-2,5-dien-4-yl]oxy-dimethyl-prop-2-enylsilane

C14H26OSi — CID 11543224

IUPAC[(2E,5E)-3,5-dimethylhepta-2,5-dien-4-yl]oxy-dimethyl-prop-2-enylsilane
SMILESC=CC[Si](C)(C)OC(/C(C)=C/C)/C(C)=C/C
InChIInChI=1S/C14H26OSi/c1-8-11-16(6,7)15-14(12(4)9-2)13(5)10-3/h8-10,14H,1,11H2,2-7H3/b12-9+,13-10+
InChIKeyMDSCBUPDFOJTBP-JOWSBRCASA-N
MW238.45 g/mol
LogP4.70
Rot. Bonds6

About [(2E,5E)-3,5-dimethylhepta-2,5-dien-4-yl]oxy-dimethyl-prop-2-enylsilane

[(2E,5E)-3,5-dimethylhepta-2,5-dien-4-yl]oxy-dimethyl-prop-2-enylsilane (PubChem CID 11543224) has the molecular formula C14H26OSi and a molecular weight of 238.45 g/mol. Its IUPAC name is [(2E,5E)-3,5-dimethylhepta-2,5-dien-4-yl]oxy-dimethyl-prop-2-enylsilane.

Molecular Properties

Compound Name[(2E,5E)-3,5-dimethylhepta-2,5-dien-4-yl]oxy-dimethyl-prop-2-enylsilane
PubChem CID11543224
Molecular FormulaC14H26OSi
Molecular Weight238.45 g/mol
Exact Mass238.18
IUPAC Name[(2E,5E)-3,5-dimethylhepta-2,5-dien-4-yl]oxy-dimethyl-prop-2-enylsilane
SMILESC=CC[Si](C)(C)OC(/C(C)=C/C)/C(C)=C/C
InChIInChI=1S/C14H26OSi/c1-8-11-16(6,7)15-14(12(4)9-2)13(5)10-3/h8-10,14H,1,11H2,2-7H3/b12-9+,13-10+
InChIKeyMDSCBUPDFOJTBP-JOWSBRCASA-N
XLogP4.70
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.45
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(2E,5E)-3,5-dimethylhepta-2,5-dien-4-yl]oxy-dimethyl-prop-2-enylsilane?
The IUPAC name of [(2E,5E)-3,5-dimethylhepta-2,5-dien-4-yl]oxy-dimethyl-prop-2-enylsilane (CID 11543224) is [(2E,5E)-3,5-dimethylhepta-2,5-dien-4-yl]oxy-dimethyl-prop-2-enylsilane.
What is the SMILES notation for [(2E,5E)-3,5-dimethylhepta-2,5-dien-4-yl]oxy-dimethyl-prop-2-enylsilane?
The canonical SMILES for [(2E,5E)-3,5-dimethylhepta-2,5-dien-4-yl]oxy-dimethyl-prop-2-enylsilane is C=CC[Si](C)(C)OC(/C(C)=C/C)/C(C)=C/C.
What is the InChIKey of [(2E,5E)-3,5-dimethylhepta-2,5-dien-4-yl]oxy-dimethyl-prop-2-enylsilane?
The InChIKey is MDSCBUPDFOJTBP-JOWSBRCASA-N. The full InChI is InChI=1S/C14H26OSi/c1-8-11-16(6,7)15-14(12(4)9-2)13(5)10-3/h8-10,14H,1,11H2,2-7H3/b12-9+,13-10+.
What are the key properties of [(2E,5E)-3,5-dimethylhepta-2,5-dien-4-yl]oxy-dimethyl-prop-2-enylsilane?
[(2E,5E)-3,5-dimethylhepta-2,5-dien-4-yl]oxy-dimethyl-prop-2-enylsilane has a molecular weight of 238.45 g/mol, XLogP of 4.70, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(2E,5E)-3,5-dimethylhepta-2,5-dien-4-yl]oxy-dimethyl-prop-2-enylsilane is sourced from PubChem (CID 11543224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).