[(3S,4R)-4-ethenylhepta-1,6-dien-3-yl]oxy-trimethylsilane

C12H22OSi — CID 10846154

IUPAC[(3S,4R)-4-ethenylhepta-1,6-dien-3-yl]oxy-trimethylsilane
SMILESC=CC[C@H](C=C)[C@H](C=C)O[Si](C)(C)C
InChIInChI=1S/C12H22OSi/c1-7-10-11(8-2)12(9-3)13-14(4,5)6/h7-9,11-12H,1-3,10H2,4-6H3/t11-,12-/m0/s1
InChIKeyOENJNZPJSKUOFJ-RYUDHWBXSA-N
MW210.39 g/mol
LogP3.77
Rot. Bonds7

About [(3S,4R)-4-ethenylhepta-1,6-dien-3-yl]oxy-trimethylsilane

[(3S,4R)-4-ethenylhepta-1,6-dien-3-yl]oxy-trimethylsilane (PubChem CID 10846154) has the molecular formula C12H22OSi and a molecular weight of 210.39 g/mol. Its IUPAC name is [(3S,4R)-4-ethenylhepta-1,6-dien-3-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[(3S,4R)-4-ethenylhepta-1,6-dien-3-yl]oxy-trimethylsilane
PubChem CID10846154
Molecular FormulaC12H22OSi
Molecular Weight210.39 g/mol
Exact Mass210.14
IUPAC Name[(3S,4R)-4-ethenylhepta-1,6-dien-3-yl]oxy-trimethylsilane
SMILESC=CC[C@H](C=C)[C@H](C=C)O[Si](C)(C)C
InChIInChI=1S/C12H22OSi/c1-7-10-11(8-2)12(9-3)13-14(4,5)6/h7-9,11-12H,1-3,10H2,4-6H3/t11-,12-/m0/s1
InChIKeyOENJNZPJSKUOFJ-RYUDHWBXSA-N
XLogP3.77
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.39
LogP ≤ 53.77
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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Related Compounds

tert-butyl-[(2S,3S)-3-ethenylhex-5-en-2-yl]oxy-dimethylsilane
CID 134863816
trimethyl(octa-1,7-dien-4-yloxy)silane
CID 18541557
(3R)-3-trimethylsilyloxyhex-5-enenitrile
CID 132509997
(3S,4S)-4-[tert-butyl(dimethyl)silyl]oxy-3-ethenylhex-5-en-1-ol
CID 10515260
2-butyl-4-trimethylsilyloxyhept-6-enal
CID 57299910
trimethyl-[(5Z,8Z)-7-trimethylsilyloxyundeca-1,5,8-trien-3-yl]oxysilane
CID 5366568
tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxybut-3-enoxy]-dimethylsilane
CID 101029883
4,4-dimethylpent-1-en-3-yloxy(trimethyl)silane
CID 13307468
(2R,3R)-3-ethenylhex-5-ene-2-sulfonamide
CID 166830456
2-trimethylsilyloxybut-3-enenitrile
CID 4084055
4-(1-trimethylsilyloxybut-3-enyl)benzonitrile
CID 132540414
ethoxy-dimethyl-pent-4-en-2-yloxysilane
CID 87655810

Frequently Asked Questions

What is the IUPAC name of [(3S,4R)-4-ethenylhepta-1,6-dien-3-yl]oxy-trimethylsilane?
The IUPAC name of [(3S,4R)-4-ethenylhepta-1,6-dien-3-yl]oxy-trimethylsilane (CID 10846154) is [(3S,4R)-4-ethenylhepta-1,6-dien-3-yl]oxy-trimethylsilane.
What is the SMILES notation for [(3S,4R)-4-ethenylhepta-1,6-dien-3-yl]oxy-trimethylsilane?
The canonical SMILES for [(3S,4R)-4-ethenylhepta-1,6-dien-3-yl]oxy-trimethylsilane is C=CC[C@H](C=C)[C@H](C=C)O[Si](C)(C)C.
What is the InChIKey of [(3S,4R)-4-ethenylhepta-1,6-dien-3-yl]oxy-trimethylsilane?
The InChIKey is OENJNZPJSKUOFJ-RYUDHWBXSA-N. The full InChI is InChI=1S/C12H22OSi/c1-7-10-11(8-2)12(9-3)13-14(4,5)6/h7-9,11-12H,1-3,10H2,4-6H3/t11-,12-/m0/s1.
What are the key properties of [(3S,4R)-4-ethenylhepta-1,6-dien-3-yl]oxy-trimethylsilane?
[(3S,4R)-4-ethenylhepta-1,6-dien-3-yl]oxy-trimethylsilane has a molecular weight of 210.39 g/mol, XLogP of 3.77, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(3S,4R)-4-ethenylhepta-1,6-dien-3-yl]oxy-trimethylsilane is sourced from PubChem (CID 10846154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).