2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol

C21H28O2Si — CID 74035630

IUPAC2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol
SMILESCC(C)(C)[Si](OCC1CCC1O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H28O2Si/c1-21(2,3)24(18-10-6-4-7-11-18,19-12-8-5-9-13-19)23-16-17-14-15-20(17)22/h4-13,17,20,22H,14-16H2,1-3H3
InChIKeyMLJYAMGTLRVBEO-UHFFFAOYSA-N
MW340.54 g/mol
LogP3.33
Rot. Bonds5

About 2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol

2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol (PubChem CID 74035630) has the molecular formula C21H28O2Si and a molecular weight of 340.54 g/mol. Its IUPAC name is 2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol.

Molecular Properties

Compound Name2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol
PubChem CID74035630
Molecular FormulaC21H28O2Si
Molecular Weight340.54 g/mol
Exact Mass340.19
IUPAC Name2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol
SMILESCC(C)(C)[Si](OCC1CCC1O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H28O2Si/c1-21(2,3)24(18-10-6-4-7-11-18,19-12-8-5-9-13-19)23-16-17-14-15-20(17)22/h4-13,17,20,22H,14-16H2,1-3H3
InChIKeyMLJYAMGTLRVBEO-UHFFFAOYSA-N
XLogP3.33
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.54
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol 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

(2S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol
CID 174251063
3-[[tert-butyl(diphenyl)silyl]oxymethyl]thian-4-ol
CID 122207177
(2S,3S,4aR,6S,7S,8aS,9aR,10aR)-6,7-bis[[tert-butyl(diphenyl)silyl]oxymethyl]-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroanthracene-2,3-diol
CID 100959653
tert-butyl-[(2-methylcyclopentyl)methoxy]-diphenylsilane
CID 123161962
4-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-[(2-methylpropan-2-yl)oxy]cyclopentane-1,2-diol
CID 71138268
[(1R,2R)-2-(bromomethyl)cyclopentyl]methoxy-tert-butyl-diphenylsilane
CID 171429782
trans-(1R,3S)-3-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methylidenecyclopentan-1-ol
CID 101065622
(1S,2R,3S)-3-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-(2,2-diphenylethenyl)cyclobutan-1-ol
CID 10369362
[(3S,4R)-4-[[tert-butyl(diphenyl)silyl]oxymethyl]pyrrolidin-3-yl]methanol
CID 178119164
2-[2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclopropyl]acetic acid
CID 146157316
(1S,2S,3R,5S,6R)-3,6-bis[[tert-butyl(diphenyl)silyl]oxymethyl]bicyclo[3.1.0]hexan-2-ol
CID 101191463
cis-(1R,2S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclopropane-1-carbaldehyde;cis-(1S,2R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclopropane-1-carbaldehyde
CID 162119958

Frequently Asked Questions

What is the IUPAC name of 2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol?
The IUPAC name of 2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol (CID 74035630) is 2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol.
What is the SMILES notation for 2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol?
The canonical SMILES for 2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol is CC(C)(C)[Si](OCC1CCC1O)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol?
The InChIKey is MLJYAMGTLRVBEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28O2Si/c1-21(2,3)24(18-10-6-4-7-11-18,19-12-8-5-9-13-19)23-16-17-14-15-20(17)22/h4-13,17,20,22H,14-16H2,1-3H3.
What are the key properties of 2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol?
2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol has a molecular weight of 340.54 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol is sourced from PubChem (CID 74035630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).