(2S)-2-cyclopropyl-2-(3,3-dimethylbutan-2-ylsilyloxy)acetaldehyde

C11H22O2Si — CID 173041532

IUPAC(2S)-2-cyclopropyl-2-(3,3-dimethylbutan-2-ylsilyloxy)acetaldehyde
SMILESCC([SiH2]O[C@H](C=O)C1CC1)C(C)(C)C
InChIInChI=1S/C11H22O2Si/c1-8(11(2,3)4)14-13-10(7-12)9-5-6-9/h7-10H,5-6,14H2,1-4H3/t8?,10-/m1/s1
InChIKeyFCABKPAABAQEHG-LHIURRSHSA-N
MW214.38 g/mol
LogP1.92
Rot. Bonds5

About (2S)-2-cyclopropyl-2-(3,3-dimethylbutan-2-ylsilyloxy)acetaldehyde

(2S)-2-cyclopropyl-2-(3,3-dimethylbutan-2-ylsilyloxy)acetaldehyde (PubChem CID 173041532) has the molecular formula C11H22O2Si and a molecular weight of 214.38 g/mol. Its IUPAC name is (2S)-2-cyclopropyl-2-(3,3-dimethylbutan-2-ylsilyloxy)acetaldehyde.

Molecular Properties

Compound Name(2S)-2-cyclopropyl-2-(3,3-dimethylbutan-2-ylsilyloxy)acetaldehyde
PubChem CID173041532
Molecular FormulaC11H22O2Si
Molecular Weight214.38 g/mol
Exact Mass214.14
IUPAC Name(2S)-2-cyclopropyl-2-(3,3-dimethylbutan-2-ylsilyloxy)acetaldehyde
SMILESCC([SiH2]O[C@H](C=O)C1CC1)C(C)(C)C
InChIInChI=1S/C11H22O2Si/c1-8(11(2,3)4)14-13-10(7-12)9-5-6-9/h7-10H,5-6,14H2,1-4H3/t8?,10-/m1/s1
InChIKeyFCABKPAABAQEHG-LHIURRSHSA-N
XLogP1.92
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.38
LogP ≤ 51.92
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'}

Analyze (2S)-2-cyclopropyl-2-(3,3-dimethylbutan-2-ylsilyloxy)acetaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-2-cyclopropyl-2-methoxyacetaldehyde
CID 124547234
3,3-dimethylbutan-2-ylcyclopropane
CID 13275215
(2S)-2-cyclopropylpropanal
CID 59475987
(2S)-2-methoxy-2-(oxan-4-yl)acetaldehyde
CID 124709657
[(1R)-1-cyclopropylethyl] formate
CID 143509718
2-(1,1-dioxothian-4-yl)-2-methoxyacetaldehyde
CID 115024689
tert-butyl-[(1R)-1-cyclopropylprop-2-enoxy]-dimethylsilane
CID 67046197
3-methyl-6-propan-2-ylazepane-1-carbaldehyde
CID 174874844
propan-2-ylcyclopropane;hydroiodide
CID 162314014
2-(4-methoxycyclohexyl)propanal
CID 173023643
(4-propan-2-ylcyclohexyl) 2,3,3-trimethylbutanoate
CID 123610766
2-cyclopropyl-3-oxopropanenitrile;2-methoxy-2-methylpropane
CID 170581782

Frequently Asked Questions

What is the IUPAC name of (2S)-2-cyclopropyl-2-(3,3-dimethylbutan-2-ylsilyloxy)acetaldehyde?
The IUPAC name of (2S)-2-cyclopropyl-2-(3,3-dimethylbutan-2-ylsilyloxy)acetaldehyde (CID 173041532) is (2S)-2-cyclopropyl-2-(3,3-dimethylbutan-2-ylsilyloxy)acetaldehyde.
What is the SMILES notation for (2S)-2-cyclopropyl-2-(3,3-dimethylbutan-2-ylsilyloxy)acetaldehyde?
The canonical SMILES for (2S)-2-cyclopropyl-2-(3,3-dimethylbutan-2-ylsilyloxy)acetaldehyde is CC([SiH2]O[C@H](C=O)C1CC1)C(C)(C)C.
What is the InChIKey of (2S)-2-cyclopropyl-2-(3,3-dimethylbutan-2-ylsilyloxy)acetaldehyde?
The InChIKey is FCABKPAABAQEHG-LHIURRSHSA-N. The full InChI is InChI=1S/C11H22O2Si/c1-8(11(2,3)4)14-13-10(7-12)9-5-6-9/h7-10H,5-6,14H2,1-4H3/t8?,10-/m1/s1.
What are the key properties of (2S)-2-cyclopropyl-2-(3,3-dimethylbutan-2-ylsilyloxy)acetaldehyde?
(2S)-2-cyclopropyl-2-(3,3-dimethylbutan-2-ylsilyloxy)acetaldehyde has a molecular weight of 214.38 g/mol, XLogP of 1.92, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-cyclopropyl-2-(3,3-dimethylbutan-2-ylsilyloxy)acetaldehyde is sourced from PubChem (CID 173041532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).