2-dimethylsilyl-3,3-dimethylbutanal

C8H18OSi — CID 173296563

IUPAC2-dimethylsilyl-3,3-dimethylbutanal
SMILESC[SiH](C)C(C=O)C(C)(C)C
InChIInChI=1S/C8H18OSi/c1-8(2,3)7(6-9)10(4)5/h6-7,10H,1-5H3
InChIKeyFKIDIJFVGRVBCA-UHFFFAOYSA-N
MW158.32 g/mol
LogP2.09
Rot. Bonds2

About 2-dimethylsilyl-3,3-dimethylbutanal

2-dimethylsilyl-3,3-dimethylbutanal (PubChem CID 173296563) has the molecular formula C8H18OSi and a molecular weight of 158.32 g/mol. Its IUPAC name is 2-dimethylsilyl-3,3-dimethylbutanal.

Molecular Properties

Compound Name2-dimethylsilyl-3,3-dimethylbutanal
PubChem CID173296563
Molecular FormulaC8H18OSi
Molecular Weight158.32 g/mol
Exact Mass158.11
IUPAC Name2-dimethylsilyl-3,3-dimethylbutanal
SMILESC[SiH](C)C(C=O)C(C)(C)C
InChIInChI=1S/C8H18OSi/c1-8(2,3)7(6-9)10(4)5/h6-7,10H,1-5H3
InChIKeyFKIDIJFVGRVBCA-UHFFFAOYSA-N
XLogP2.09
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.32
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-Ethyl-2-(trimethylsilylmethyl)butanal
CID 12836132
3,3-Dimethyl-5-trimethylsilylpent-4-ynal
CID 23643368
4-(Tert-butyl-dimethyl-silanyloxy)-3,3-dimethyl-butyraldehyde
CID 10489671
2,2-Dimethyl-5-trimethylsilylpent-4-ynal
CID 13736308
4-[Tert-butyl(dimethyl)silyl]oxy-2,2-dimethylbutanal
CID 22996398
2-Ethyl-2-trimethylsilylbutanal
CID 87950595
3-[Tert-butyl(dimethyl)silyl]butanal
CID 89544057
2,2-Dimethyl-3-(trimethylsilyl)propanal
CID 91512077
4-[Butyl(dimethyl)silyl]oxy-2,2-dimethylbutanal
CID 91591248
tert-butyl(dimethyl)silane;(2S)-2-methylbutanal
CID 123181168
2,2-Dimethyl-4-trimethoxysilylbutanal
CID 140227171
2,2-Dimethyl-3-silylbutanal
CID 174386989

Frequently Asked Questions

What is the IUPAC name of 2-dimethylsilyl-3,3-dimethylbutanal?
The IUPAC name of 2-dimethylsilyl-3,3-dimethylbutanal (CID 173296563) is 2-dimethylsilyl-3,3-dimethylbutanal.
What is the SMILES notation for 2-dimethylsilyl-3,3-dimethylbutanal?
The canonical SMILES for 2-dimethylsilyl-3,3-dimethylbutanal is C[SiH](C)C(C=O)C(C)(C)C.
What is the InChIKey of 2-dimethylsilyl-3,3-dimethylbutanal?
The InChIKey is FKIDIJFVGRVBCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18OSi/c1-8(2,3)7(6-9)10(4)5/h6-7,10H,1-5H3.
What are the key properties of 2-dimethylsilyl-3,3-dimethylbutanal?
2-dimethylsilyl-3,3-dimethylbutanal has a molecular weight of 158.32 g/mol, XLogP of 2.09, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dimethylsilyl-3,3-dimethylbutanal is sourced from PubChem (CID 173296563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).