[(Z)-3-butoxyprop-2-enoxy]-tri(propan-2-yl)silane

C16H34O2Si — CID 135061750

IUPAC[(Z)-3-butoxyprop-2-enoxy]-tri(propan-2-yl)silane
SMILESCCCCO/C=C\CO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C16H34O2Si/c1-8-9-11-17-12-10-13-18-19(14(2)3,15(4)5)16(6)7/h10,12,14-16H,8-9,11,13H2,1-7H3/b12-10-
InChIKeyIAWLJOCBYKCKAF-BENRWUELSA-N
MW286.53 g/mol
LogP5.51
Rot. Bonds10

About [(Z)-3-butoxyprop-2-enoxy]-tri(propan-2-yl)silane

[(Z)-3-butoxyprop-2-enoxy]-tri(propan-2-yl)silane (PubChem CID 135061750) has the molecular formula C16H34O2Si and a molecular weight of 286.53 g/mol. Its IUPAC name is [(Z)-3-butoxyprop-2-enoxy]-tri(propan-2-yl)silane.

Molecular Properties

Compound Name[(Z)-3-butoxyprop-2-enoxy]-tri(propan-2-yl)silane
PubChem CID135061750
Molecular FormulaC16H34O2Si
Molecular Weight286.53 g/mol
Exact Mass286.23
IUPAC Name[(Z)-3-butoxyprop-2-enoxy]-tri(propan-2-yl)silane
SMILESCCCCO/C=C\CO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C16H34O2Si/c1-8-9-11-17-12-10-13-18-19(14(2)3,15(4)5)16(6)7/h10,12,14-16H,8-9,11,13H2,1-7H3/b12-10-
InChIKeyIAWLJOCBYKCKAF-BENRWUELSA-N
XLogP5.51
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500286.53
LogP ≤ 55.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

trans-1-Methoxy-3-(triethylsilyloxy)-1,3-butadiene
CID 11298858
[(3E)-4-methoxybuta-1,3-dien-2-yl]oxy-tri(propan-2-yl)silane
CID 101985442
triethyl-[(Z)-3-methoxy-1-triethylsilylprop-2-enyl]silane
CID 102054801
[(Z)-1-deuterio-3-propoxy-1-triethylsilylprop-2-enyl]-triethylsilane
CID 135020963
[(3E)-4-ethoxybuta-1,3-dien-2-yl]oxy-triethylsilane
CID 19080257
[(1E)-3-butoxybuta-1,3-dienoxy]-tri(propan-2-yl)silane
CID 19873323
Triethyl(4-methoxybuta-1,3-dien-2-yloxy)silane
CID 53637888
Diethoxy-methyl-(3-prop-1-enoxypropyl)silane
CID 54012434
3-Butoxybuta-1,3-dienoxy-tri(propan-2-yl)silane
CID 54263285
Hydroxy-dimethyl-(3-prop-1-enoxypropyl)silane
CID 54339393
4-Ethoxybuta-1,3-dien-2-yloxy(triethyl)silane
CID 54517809
Diethoxy-methyl-(1-prop-1-enoxypropyl)silane
CID 57240141

Frequently Asked Questions

What is the IUPAC name of [(Z)-3-butoxyprop-2-enoxy]-tri(propan-2-yl)silane?
The IUPAC name of [(Z)-3-butoxyprop-2-enoxy]-tri(propan-2-yl)silane (CID 135061750) is [(Z)-3-butoxyprop-2-enoxy]-tri(propan-2-yl)silane.
What is the SMILES notation for [(Z)-3-butoxyprop-2-enoxy]-tri(propan-2-yl)silane?
The canonical SMILES for [(Z)-3-butoxyprop-2-enoxy]-tri(propan-2-yl)silane is CCCCO/C=C\CO[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of [(Z)-3-butoxyprop-2-enoxy]-tri(propan-2-yl)silane?
The InChIKey is IAWLJOCBYKCKAF-BENRWUELSA-N. The full InChI is InChI=1S/C16H34O2Si/c1-8-9-11-17-12-10-13-18-19(14(2)3,15(4)5)16(6)7/h10,12,14-16H,8-9,11,13H2,1-7H3/b12-10-.
What are the key properties of [(Z)-3-butoxyprop-2-enoxy]-tri(propan-2-yl)silane?
[(Z)-3-butoxyprop-2-enoxy]-tri(propan-2-yl)silane has a molecular weight of 286.53 g/mol, XLogP of 5.51, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-3-butoxyprop-2-enoxy]-tri(propan-2-yl)silane is sourced from PubChem (CID 135061750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).