(2S)-2-(2,6-dichlorophenyl)-2-trimethylsilyloxyacetaldehyde

C11H14Cl2O2Si — CID 125465616

IUPAC(2S)-2-(2,6-dichlorophenyl)-2-trimethylsilyloxyacetaldehyde
SMILESC[Si](C)(C)O[C@H](C=O)c1c(Cl)cccc1Cl
InChIInChI=1S/C11H14Cl2O2Si/c1-16(2,3)15-10(7-14)11-8(12)5-4-6-9(11)13/h4-7,10H,1-3H3/t10-/m1/s1
InChIKeyMLWOZESOGNFJCM-SNVBAGLBSA-N
MW277.22 g/mol
LogP4.08
Rot. Bonds4

About (2S)-2-(2,6-dichlorophenyl)-2-trimethylsilyloxyacetaldehyde

(2S)-2-(2,6-dichlorophenyl)-2-trimethylsilyloxyacetaldehyde (PubChem CID 125465616) has the molecular formula C11H14Cl2O2Si and a molecular weight of 277.22 g/mol. Its IUPAC name is (2S)-2-(2,6-dichlorophenyl)-2-trimethylsilyloxyacetaldehyde.

Molecular Properties

Compound Name(2S)-2-(2,6-dichlorophenyl)-2-trimethylsilyloxyacetaldehyde
PubChem CID125465616
Molecular FormulaC11H14Cl2O2Si
Molecular Weight277.22 g/mol
Exact Mass276.01
IUPAC Name(2S)-2-(2,6-dichlorophenyl)-2-trimethylsilyloxyacetaldehyde
SMILESC[Si](C)(C)O[C@H](C=O)c1c(Cl)cccc1Cl
InChIInChI=1S/C11H14Cl2O2Si/c1-16(2,3)15-10(7-14)11-8(12)5-4-6-9(11)13/h4-7,10H,1-3H3/t10-/m1/s1
InChIKeyMLWOZESOGNFJCM-SNVBAGLBSA-N
XLogP4.08
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.22
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[(2,6-dichlorophenyl)-isocyanomethoxy]-trimethylsilane
CID 123844422
2-(3-chloro-2-fluorophenyl)-2-methoxyacetaldehyde
CID 130624407
1,2-dichlorobenzene;methyl formate
CID 162103259
(2S)-2-(2,6-dichlorophenyl)-3-oxopropanenitrile
CID 93296296
2-(2-chloro-6-ethoxyphenyl)propanal
CID 134639769
1,3-dichloro-2-propan-2-ylbenzene
CID 14028117
[1-[2-chloro-6-(iodomethyl)phenyl]-3-methyl-1-trimethylsilyloxybutan-2-yl]oxy-trimethylsilane
CID 90430909
2-chlorobenzaldehyde;(2S)-2-(2-chlorophenyl)-2-trimethylsilyloxyacetonitrile
CID 158704674
[(1S)-1-(2-chlorophenyl)-2-methylpropoxy]-trimethylsilane
CID 159975802
2-[(2,6-dichlorophenyl)methoxy]propanal
CID 71342510
[2-bromo-1-(2,6-dichlorophenyl)ethoxy]-tert-butyl-dimethylsilane
CID 169498298
2,6-dichlorobenzaldehyde;ethane
CID 90823593

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(2,6-dichlorophenyl)-2-trimethylsilyloxyacetaldehyde?
The IUPAC name of (2S)-2-(2,6-dichlorophenyl)-2-trimethylsilyloxyacetaldehyde (CID 125465616) is (2S)-2-(2,6-dichlorophenyl)-2-trimethylsilyloxyacetaldehyde.
What is the SMILES notation for (2S)-2-(2,6-dichlorophenyl)-2-trimethylsilyloxyacetaldehyde?
The canonical SMILES for (2S)-2-(2,6-dichlorophenyl)-2-trimethylsilyloxyacetaldehyde is C[Si](C)(C)O[C@H](C=O)c1c(Cl)cccc1Cl.
What is the InChIKey of (2S)-2-(2,6-dichlorophenyl)-2-trimethylsilyloxyacetaldehyde?
The InChIKey is MLWOZESOGNFJCM-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H14Cl2O2Si/c1-16(2,3)15-10(7-14)11-8(12)5-4-6-9(11)13/h4-7,10H,1-3H3/t10-/m1/s1.
What are the key properties of (2S)-2-(2,6-dichlorophenyl)-2-trimethylsilyloxyacetaldehyde?
(2S)-2-(2,6-dichlorophenyl)-2-trimethylsilyloxyacetaldehyde has a molecular weight of 277.22 g/mol, XLogP of 4.08, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(2,6-dichlorophenyl)-2-trimethylsilyloxyacetaldehyde is sourced from PubChem (CID 125465616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).