[tert-butyl(dimethyl)silyl]-cyclopropylmethanone

C10H20OSi — CID 552806

IUPAC[tert-butyl(dimethyl)silyl]-cyclopropylmethanone
SMILESCC(C)(C)[Si](C)(C)C(=O)C1CC1
InChIInChI=1S/C10H20OSi/c1-10(2,3)12(4,5)9(11)8-6-7-8/h8H,6-7H2,1-5H3
InChIKeyITMBFNZCPVPDEL-UHFFFAOYSA-N
MW184.35 g/mol
LogP3.01
Rot. Bonds2

About [tert-butyl(dimethyl)silyl]-cyclopropylmethanone

[tert-butyl(dimethyl)silyl]-cyclopropylmethanone (PubChem CID 552806) has the molecular formula C10H20OSi and a molecular weight of 184.35 g/mol. Its IUPAC name is [tert-butyl(dimethyl)silyl]-cyclopropylmethanone.

Molecular Properties

Compound Name[tert-butyl(dimethyl)silyl]-cyclopropylmethanone
PubChem CID552806
Molecular FormulaC10H20OSi
Molecular Weight184.35 g/mol
Exact Mass184.13
IUPAC Name[tert-butyl(dimethyl)silyl]-cyclopropylmethanone
SMILESCC(C)(C)[Si](C)(C)C(=O)C1CC1
InChIInChI=1S/C10H20OSi/c1-10(2,3)12(4,5)9(11)8-6-7-8/h8H,6-7H2,1-5H3
InChIKeyITMBFNZCPVPDEL-UHFFFAOYSA-N
XLogP3.01
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.35
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [tert-butyl(dimethyl)silyl]-cyclopropylmethanone?
The IUPAC name of [tert-butyl(dimethyl)silyl]-cyclopropylmethanone (CID 552806) is [tert-butyl(dimethyl)silyl]-cyclopropylmethanone.
What is the SMILES notation for [tert-butyl(dimethyl)silyl]-cyclopropylmethanone?
The canonical SMILES for [tert-butyl(dimethyl)silyl]-cyclopropylmethanone is CC(C)(C)[Si](C)(C)C(=O)C1CC1.
What is the InChIKey of [tert-butyl(dimethyl)silyl]-cyclopropylmethanone?
The InChIKey is ITMBFNZCPVPDEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20OSi/c1-10(2,3)12(4,5)9(11)8-6-7-8/h8H,6-7H2,1-5H3.
What are the key properties of [tert-butyl(dimethyl)silyl]-cyclopropylmethanone?
[tert-butyl(dimethyl)silyl]-cyclopropylmethanone has a molecular weight of 184.35 g/mol, XLogP of 3.01, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [tert-butyl(dimethyl)silyl]-cyclopropylmethanone is sourced from PubChem (CID 552806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).