2-[1-[tert-butyl(dimethyl)silyl]oxycyclopropyl]acetaldehyde

C11H22O2Si — CID 86614119

IUPAC2-[1-[tert-butyl(dimethyl)silyl]oxycyclopropyl]acetaldehyde
SMILESCC(C)(C)[Si](C)(C)OC1(CC=O)CC1
InChIInChI=1S/C11H22O2Si/c1-10(2,3)14(4,5)13-11(6-7-11)8-9-12/h9H,6-8H2,1-5H3
InChIKeyDHQHYAJJUXLKJM-UHFFFAOYSA-N
MW214.38 g/mol
LogP3.13
Rot. Bonds4

About 2-[1-[tert-butyl(dimethyl)silyl]oxycyclopropyl]acetaldehyde

2-[1-[tert-butyl(dimethyl)silyl]oxycyclopropyl]acetaldehyde (PubChem CID 86614119) has the molecular formula C11H22O2Si and a molecular weight of 214.38 g/mol. Its IUPAC name is 2-[1-[tert-butyl(dimethyl)silyl]oxycyclopropyl]acetaldehyde.

Molecular Properties

Compound Name2-[1-[tert-butyl(dimethyl)silyl]oxycyclopropyl]acetaldehyde
PubChem CID86614119
Molecular FormulaC11H22O2Si
Molecular Weight214.38 g/mol
Exact Mass214.14
IUPAC Name2-[1-[tert-butyl(dimethyl)silyl]oxycyclopropyl]acetaldehyde
SMILESCC(C)(C)[Si](C)(C)OC1(CC=O)CC1
InChIInChI=1S/C11H22O2Si/c1-10(2,3)14(4,5)13-11(6-7-11)8-9-12/h9H,6-8H2,1-5H3
InChIKeyDHQHYAJJUXLKJM-UHFFFAOYSA-N
XLogP3.13
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.38
LogP ≤ 53.13
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 2-[1-[tert-butyl(dimethyl)silyl]oxycyclopropyl]acetaldehyde with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[1-[tert-butyl(dimethyl)silyl]oxycyclopropyl]acetaldehyde?
The IUPAC name of 2-[1-[tert-butyl(dimethyl)silyl]oxycyclopropyl]acetaldehyde (CID 86614119) is 2-[1-[tert-butyl(dimethyl)silyl]oxycyclopropyl]acetaldehyde.
What is the SMILES notation for 2-[1-[tert-butyl(dimethyl)silyl]oxycyclopropyl]acetaldehyde?
The canonical SMILES for 2-[1-[tert-butyl(dimethyl)silyl]oxycyclopropyl]acetaldehyde is CC(C)(C)[Si](C)(C)OC1(CC=O)CC1.
What is the InChIKey of 2-[1-[tert-butyl(dimethyl)silyl]oxycyclopropyl]acetaldehyde?
The InChIKey is DHQHYAJJUXLKJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2Si/c1-10(2,3)14(4,5)13-11(6-7-11)8-9-12/h9H,6-8H2,1-5H3.
What are the key properties of 2-[1-[tert-butyl(dimethyl)silyl]oxycyclopropyl]acetaldehyde?
2-[1-[tert-butyl(dimethyl)silyl]oxycyclopropyl]acetaldehyde has a molecular weight of 214.38 g/mol, XLogP of 3.13, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[tert-butyl(dimethyl)silyl]oxycyclopropyl]acetaldehyde is sourced from PubChem (CID 86614119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).