3-[(Z)-hex-3-enoxy]prop-1-ynyl-tri(propan-2-yl)silane

C18H34OSi — CID 145444564

IUPAC3-[(Z)-hex-3-enoxy]prop-1-ynyl-tri(propan-2-yl)silane
SMILESCC/C=C\CCOCC#C[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C18H34OSi/c1-8-9-10-11-13-19-14-12-15-20(16(2)3,17(4)5)18(6)7/h9-10,16-18H,8,11,13-14H2,1-7H3/b10-9-
InChIKeyKGNCGLVSMONQME-KTKRTIGZSA-N
MW294.56 g/mol
LogP5.58
Rot. Bonds8

About 3-[(Z)-hex-3-enoxy]prop-1-ynyl-tri(propan-2-yl)silane

3-[(Z)-hex-3-enoxy]prop-1-ynyl-tri(propan-2-yl)silane (PubChem CID 145444564) has the molecular formula C18H34OSi and a molecular weight of 294.56 g/mol. Its IUPAC name is 3-[(Z)-hex-3-enoxy]prop-1-ynyl-tri(propan-2-yl)silane.

Molecular Properties

Compound Name3-[(Z)-hex-3-enoxy]prop-1-ynyl-tri(propan-2-yl)silane
PubChem CID145444564
Molecular FormulaC18H34OSi
Molecular Weight294.56 g/mol
Exact Mass294.24
IUPAC Name3-[(Z)-hex-3-enoxy]prop-1-ynyl-tri(propan-2-yl)silane
SMILESCC/C=C\CCOCC#C[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C18H34OSi/c1-8-9-10-11-13-19-14-12-15-20(16(2)3,17(4)5)18(6)7/h9-10,16-18H,8,11,13-14H2,1-7H3/b10-9-
InChIKeyKGNCGLVSMONQME-KTKRTIGZSA-N
XLogP5.58
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.56
LogP ≤ 55.58
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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

3-(Triisopropylsilyl)propargyl((Z)-5,5,5-trifluoro-3-pentenyl) ether
CID 132542107
[(3E,5E,7E,9E)-dodeca-3,5,7,9-tetraen-11-ynoxy]-tri(propan-2-yl)silane
CID 10882108
tert-butyl-[(E)-hept-3-en-5-ynoxy]-dimethylsilane
CID 102422553
[(Z)-8-ethoxyoct-2-en-6-ynyl]-trimethylsilane
CID 59898771
[(Z)-10-ethoxydec-4-en-1,8-diynyl]-trimethylsilane
CID 59905109
((E)-7-methoxyhept-3-en-1-yn-1-yl)trimethylsilane
CID 86679297
7-Methoxyhept-3-en-1-ynyl(trimethyl)silane
CID 123827475
tri(propan-2-yl)-[(3E,5E,7E,9E,11E)-tetradeca-3,5,7,9,11-pentaen-13-ynoxy]silane
CID 10546212
trimethyl-[(3E,5E,7E,9E)-12-tri(propan-2-yl)silyloxydodeca-3,5,7,9-tetraen-1-ynyl]silane
CID 10938295
[(E)-10-ethoxydec-4-en-1,8-diynyl]-trimethylsilane
CID 22962106
2-butoxyethyl-dimethyl-[(2E,6E)-octa-2,6-dienyl]silane
CID 23265976
trimethyl-[(E)-6-tri(propan-2-yl)silyloxyhex-3-en-1-ynyl]silane
CID 102427449

Frequently Asked Questions

What is the IUPAC name of 3-[(Z)-hex-3-enoxy]prop-1-ynyl-tri(propan-2-yl)silane?
The IUPAC name of 3-[(Z)-hex-3-enoxy]prop-1-ynyl-tri(propan-2-yl)silane (CID 145444564) is 3-[(Z)-hex-3-enoxy]prop-1-ynyl-tri(propan-2-yl)silane.
What is the SMILES notation for 3-[(Z)-hex-3-enoxy]prop-1-ynyl-tri(propan-2-yl)silane?
The canonical SMILES for 3-[(Z)-hex-3-enoxy]prop-1-ynyl-tri(propan-2-yl)silane is CC/C=C\CCOCC#C[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of 3-[(Z)-hex-3-enoxy]prop-1-ynyl-tri(propan-2-yl)silane?
The InChIKey is KGNCGLVSMONQME-KTKRTIGZSA-N. The full InChI is InChI=1S/C18H34OSi/c1-8-9-10-11-13-19-14-12-15-20(16(2)3,17(4)5)18(6)7/h9-10,16-18H,8,11,13-14H2,1-7H3/b10-9-.
What are the key properties of 3-[(Z)-hex-3-enoxy]prop-1-ynyl-tri(propan-2-yl)silane?
3-[(Z)-hex-3-enoxy]prop-1-ynyl-tri(propan-2-yl)silane has a molecular weight of 294.56 g/mol, XLogP of 5.58, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(Z)-hex-3-enoxy]prop-1-ynyl-tri(propan-2-yl)silane is sourced from PubChem (CID 145444564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).