(2R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolane-2-carboxylic acid

C22H28O4Si — CID 66663469

IUPAC(2R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolane-2-carboxylic acid
SMILESCC(C)(C)[Si](OCC1CC[C@H](C(=O)O)O1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H28O4Si/c1-22(2,3)27(18-10-6-4-7-11-18,19-12-8-5-9-13-19)25-16-17-14-15-20(26-17)21(23)24/h4-13,17,20H,14-16H2,1-3H3,(H,23,24)/t17?,20-/m1/s1
InChIKeyLQRHZOFUPVDOIG-UUSAFJCLSA-N
MW384.55 g/mol
LogP3.20
Rot. Bonds6

About (2R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolane-2-carboxylic acid

(2R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolane-2-carboxylic acid (PubChem CID 66663469) has the molecular formula C22H28O4Si and a molecular weight of 384.55 g/mol. Its IUPAC name is (2R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolane-2-carboxylic acid.

Molecular Properties

Compound Name(2R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolane-2-carboxylic acid
PubChem CID66663469
Molecular FormulaC22H28O4Si
Molecular Weight384.55 g/mol
Exact Mass384.18
IUPAC Name(2R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolane-2-carboxylic acid
SMILESCC(C)(C)[Si](OCC1CC[C@H](C(=O)O)O1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H28O4Si/c1-22(2,3)27(18-10-6-4-7-11-18,19-12-8-5-9-13-19)25-16-17-14-15-20(26-17)21(23)24/h4-13,17,20H,14-16H2,1-3H3,(H,23,24)/t17?,20-/m1/s1
InChIKeyLQRHZOFUPVDOIG-UUSAFJCLSA-N
XLogP3.20
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.55
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (2R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolane-2-carboxylic acid 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,5S)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolan-2-yl]methanol
CID 10981523
tert-butyl-[[(2S,5S)-5-[(Z)-2-iodoethenyl]oxolan-2-yl]methoxy]-diphenylsilane
CID 57408148
(2S,5S)-5-[(2S,5S)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolan-2-yl]oxolane-2-carbaldehyde
CID 11070201
4-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolane-2-carboxylic acid
CID 155658327
1-[(2R)-2-[(2R,5S)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolan-2-yl]but-3-yn-2-yl]oxypropan-2-one
CID 11070636
(2R)-2-[(2R,6R)-6-[[tert-butyl(diphenyl)silyl]oxymethyl]oxan-2-yl]-2-hydroxy-1-phenylethanone
CID 11799218
[(2S,3R,6S)-6-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-decyloxan-3-yl] acetate
CID 101031088
tert-butyl N-[(3R,6S)-6-[[tert-butyl(diphenyl)silyl]oxymethyl]oxan-3-yl]carbamate
CID 142544419
tert-butyl-[[(2S)-oxolan-2-yl]methoxy]-diphenylsilane
CID 56616386
(3R,6S)-6-[[tert-butyl(diphenyl)silyl]oxymethyl]oxan-3-amine
CID 142544481
tert-butyl-[[(2R,5R)-5-(diethoxyphosphorylmethoxy)oxolan-2-yl]methoxy]-diphenylsilane
CID 59795858
[(3R,4R,7S)-2-benzoyloxy-7-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-phenylmethoxyoxepan-3-yl] benzoate
CID 58940425

Frequently Asked Questions

What is the IUPAC name of (2R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolane-2-carboxylic acid?
The IUPAC name of (2R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolane-2-carboxylic acid (CID 66663469) is (2R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolane-2-carboxylic acid.
What is the SMILES notation for (2R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolane-2-carboxylic acid?
The canonical SMILES for (2R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolane-2-carboxylic acid is CC(C)(C)[Si](OCC1CC[C@H](C(=O)O)O1)(c1ccccc1)c1ccccc1.
What is the InChIKey of (2R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolane-2-carboxylic acid?
The InChIKey is LQRHZOFUPVDOIG-UUSAFJCLSA-N. The full InChI is InChI=1S/C22H28O4Si/c1-22(2,3)27(18-10-6-4-7-11-18,19-12-8-5-9-13-19)25-16-17-14-15-20(26-17)21(23)24/h4-13,17,20H,14-16H2,1-3H3,(H,23,24)/t17?,20-/m1/s1.
What are the key properties of (2R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolane-2-carboxylic acid?
(2R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolane-2-carboxylic acid has a molecular weight of 384.55 g/mol, XLogP of 3.20, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolane-2-carboxylic acid is sourced from PubChem (CID 66663469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).