[3-[(1R)-1-deuterioprop-2-enoxy]-1-triethylsilylpropyl]-triethylsilane

C18H40OSi2 — CID 138962818

IUPAC[3-[(1R)-1-deuterioprop-2-enoxy]-1-triethylsilylpropyl]-triethylsilane
SMILES[2H][C@H](C=C)OCCC([Si](CC)(CC)CC)[Si](CC)(CC)CC
InChIInChI=1S/C18H40OSi2/c1-8-16-19-17-15-18(20(9-2,10-3)11-4)21(12-5,13-6)14-7/h8,18H,1,9-17H2,2-7H3/i16D/t16-/m1/s1
InChIKeyMYBZZGJUYMESJN-MLQNGQGISA-N
MW329.70 g/mol
LogP6.51
Rot. Bonds13

About [3-[(1R)-1-deuterioprop-2-enoxy]-1-triethylsilylpropyl]-triethylsilane

[3-[(1R)-1-deuterioprop-2-enoxy]-1-triethylsilylpropyl]-triethylsilane (PubChem CID 138962818) has the molecular formula C18H40OSi2 and a molecular weight of 329.70 g/mol. Its IUPAC name is [3-[(1R)-1-deuterioprop-2-enoxy]-1-triethylsilylpropyl]-triethylsilane.

Molecular Properties

Compound Name[3-[(1R)-1-deuterioprop-2-enoxy]-1-triethylsilylpropyl]-triethylsilane
PubChem CID138962818
Molecular FormulaC18H40OSi2
Molecular Weight329.70 g/mol
Exact Mass329.27
IUPAC Name[3-[(1R)-1-deuterioprop-2-enoxy]-1-triethylsilylpropyl]-triethylsilane
SMILES[2H][C@H](C=C)OCCC([Si](CC)(CC)CC)[Si](CC)(CC)CC
InChIInChI=1S/C18H40OSi2/c1-8-16-19-17-15-18(20(9-2,10-3)11-4)21(12-5,13-6)14-7/h8,18H,1,9-17H2,2-7H3/i16D/t16-/m1/s1
InChIKeyMYBZZGJUYMESJN-MLQNGQGISA-N
XLogP6.51
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.70
LogP ≤ 56.51
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

Trimethyl(2-prop-2-enoxyethyl)silane
CID 13497292
[(E)-3-methoxyprop-1-enyl]-trimethylsilane
CID 10749306
triethyl-[(E)-3-prop-2-enoxyprop-1-enyl]silane
CID 11252842
Tri(propan-2-yl)-(3-prop-2-enoxypropoxy)silane
CID 101985346
triethyl-[(Z)-3-prop-2-enoxy-1-triethylsilylprop-2-enyl]silane
CID 102054803
[(Z)-1-deuterio-3-prop-2-enoxy-1-triethylsilylprop-2-enyl]-triethylsilane
CID 135020895
[dimethyl-[(E)-5-prop-2-enoxypent-1-enyl]silyl]oxy-dimethyl-[(E)-5-prop-2-enoxypent-1-enyl]silane
CID 135070183
triethyl-[(Z)-1-triethylsilyl-3-[(E)-3-trimethylsilylprop-2-enoxy]prop-2-enyl]silane
CID 135071333
[(E)-3-butoxyprop-1-enyl]-trimethylsilane
CID 138970914
Trimethyl(3-prop-2-enoxyprop-1-ynyl)silane
CID 11030242
Diethoxy-methyl-(3-prop-2-enoxypropyl)silane
CID 14848119
4-[Dimethyl-[3-(2-methylprop-2-enoxy)propyl]silyl]butyl-dimethyl-[3-(2-methylprop-2-enoxy)propyl]silane
CID 19863872

Frequently Asked Questions

What is the IUPAC name of [3-[(1R)-1-deuterioprop-2-enoxy]-1-triethylsilylpropyl]-triethylsilane?
The IUPAC name of [3-[(1R)-1-deuterioprop-2-enoxy]-1-triethylsilylpropyl]-triethylsilane (CID 138962818) is [3-[(1R)-1-deuterioprop-2-enoxy]-1-triethylsilylpropyl]-triethylsilane.
What is the SMILES notation for [3-[(1R)-1-deuterioprop-2-enoxy]-1-triethylsilylpropyl]-triethylsilane?
The canonical SMILES for [3-[(1R)-1-deuterioprop-2-enoxy]-1-triethylsilylpropyl]-triethylsilane is [2H][C@H](C=C)OCCC([Si](CC)(CC)CC)[Si](CC)(CC)CC.
What is the InChIKey of [3-[(1R)-1-deuterioprop-2-enoxy]-1-triethylsilylpropyl]-triethylsilane?
The InChIKey is MYBZZGJUYMESJN-MLQNGQGISA-N. The full InChI is InChI=1S/C18H40OSi2/c1-8-16-19-17-15-18(20(9-2,10-3)11-4)21(12-5,13-6)14-7/h8,18H,1,9-17H2,2-7H3/i16D/t16-/m1/s1.
What are the key properties of [3-[(1R)-1-deuterioprop-2-enoxy]-1-triethylsilylpropyl]-triethylsilane?
[3-[(1R)-1-deuterioprop-2-enoxy]-1-triethylsilylpropyl]-triethylsilane has a molecular weight of 329.70 g/mol, XLogP of 6.51, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(1R)-1-deuterioprop-2-enoxy]-1-triethylsilylpropyl]-triethylsilane is sourced from PubChem (CID 138962818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).