(2-ethoxy-3-phenylpent-3-en-2-yl)-oxosilane

C13H18O2Si — CID 154296941

IUPAC(2-ethoxy-3-phenylpent-3-en-2-yl)-oxosilane
SMILESCC=C(c1ccccc1)C(C)(OCC)[SiH]=O
InChIInChI=1S/C13H18O2Si/c1-4-12(11-9-7-6-8-10-11)13(3,16-14)15-5-2/h4,6-10,16H,5H2,1-3H3
InChIKeyKMSJUGBWYHHPGV-UHFFFAOYSA-N
MW234.37 g/mol
LogP2.62
Rot. Bonds5

About (2-ethoxy-3-phenylpent-3-en-2-yl)-oxosilane

(2-ethoxy-3-phenylpent-3-en-2-yl)-oxosilane (PubChem CID 154296941) has the molecular formula C13H18O2Si and a molecular weight of 234.37 g/mol. Its IUPAC name is (2-ethoxy-3-phenylpent-3-en-2-yl)-oxosilane.

Molecular Properties

Compound Name(2-ethoxy-3-phenylpent-3-en-2-yl)-oxosilane
PubChem CID154296941
Molecular FormulaC13H18O2Si
Molecular Weight234.37 g/mol
Exact Mass234.11
IUPAC Name(2-ethoxy-3-phenylpent-3-en-2-yl)-oxosilane
SMILESCC=C(c1ccccc1)C(C)(OCC)[SiH]=O
InChIInChI=1S/C13H18O2Si/c1-4-12(11-9-7-6-8-10-11)13(3,16-14)15-5-2/h4,6-10,16H,5H2,1-3H3
InChIKeyKMSJUGBWYHHPGV-UHFFFAOYSA-N
XLogP2.62
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.37
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-ethoxy-2-methyl-1-phenylbutan-1-one
CID 116746857
N'-(2-ethoxy-2-methylpropyl)benzenecarboximidamide
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benzoic acid;ethyl formate
CID 158867459
benzoic acid;ethoxydiazene
CID 172820876
[(E)-4,4-dimethyl-3-phenylpent-2-enyl] acetate
CID 11368271
1,2-diphenylethane-1,2-dione;ethoxyethane
CID 67496620
ethyl 2-[[methoxy(phenyl)methylidene]amino]-2-methylpropanoate
CID 101035692
N'-(1-ethoxy-1-phenylethyl)benzohydrazide
CID 142685922
[(Z)-1-diethoxyphosphorylprop-1-enyl]benzene
CID 15103917
ethyl (Z)-3-phenylpent-3-enoate
CID 134988020
acetaldehyde;benzoic acid
CID 142179743
(E)-1-(2-tert-butylsulfanylphenyl)-3-methyl-2-phenylpent-1-en-3-ol
CID 10925866

Frequently Asked Questions

What is the IUPAC name of (2-ethoxy-3-phenylpent-3-en-2-yl)-oxosilane?
The IUPAC name of (2-ethoxy-3-phenylpent-3-en-2-yl)-oxosilane (CID 154296941) is (2-ethoxy-3-phenylpent-3-en-2-yl)-oxosilane.
What is the SMILES notation for (2-ethoxy-3-phenylpent-3-en-2-yl)-oxosilane?
The canonical SMILES for (2-ethoxy-3-phenylpent-3-en-2-yl)-oxosilane is CC=C(c1ccccc1)C(C)(OCC)[SiH]=O.
What is the InChIKey of (2-ethoxy-3-phenylpent-3-en-2-yl)-oxosilane?
The InChIKey is KMSJUGBWYHHPGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O2Si/c1-4-12(11-9-7-6-8-10-11)13(3,16-14)15-5-2/h4,6-10,16H,5H2,1-3H3.
What are the key properties of (2-ethoxy-3-phenylpent-3-en-2-yl)-oxosilane?
(2-ethoxy-3-phenylpent-3-en-2-yl)-oxosilane has a molecular weight of 234.37 g/mol, XLogP of 2.62, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethoxy-3-phenylpent-3-en-2-yl)-oxosilane is sourced from PubChem (CID 154296941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).