(2R,3S)-4-[tert-butyl(dimethyl)silyl]oxy-2,3-bis(phenylmethoxy)butanal

C24H34O4Si — CID 10364489

IUPAC(2R,3S)-4-[tert-butyl(dimethyl)silyl]oxy-2,3-bis(phenylmethoxy)butanal
SMILESCC(C)(C)[Si](C)(C)OC[C@H](OCc1ccccc1)[C@H](C=O)OCc1ccccc1
InChIInChI=1S/C24H34O4Si/c1-24(2,3)29(4,5)28-19-23(27-18-21-14-10-7-11-15-21)22(16-25)26-17-20-12-8-6-9-13-20/h6-16,22-23H,17-19H2,1-5H3/t22-,23-/m0/s1
InChIKeyFMKWWEWQTIRQKM-GOTSBHOMSA-N
MW414.62 g/mol
LogP5.38
Rot. Bonds11

About (2R,3S)-4-[tert-butyl(dimethyl)silyl]oxy-2,3-bis(phenylmethoxy)butanal

(2R,3S)-4-[tert-butyl(dimethyl)silyl]oxy-2,3-bis(phenylmethoxy)butanal (PubChem CID 10364489) has the molecular formula C24H34O4Si and a molecular weight of 414.62 g/mol. Its IUPAC name is (2R,3S)-4-[tert-butyl(dimethyl)silyl]oxy-2,3-bis(phenylmethoxy)butanal.

Molecular Properties

Compound Name(2R,3S)-4-[tert-butyl(dimethyl)silyl]oxy-2,3-bis(phenylmethoxy)butanal
PubChem CID10364489
Molecular FormulaC24H34O4Si
Molecular Weight414.62 g/mol
Exact Mass414.22
IUPAC Name(2R,3S)-4-[tert-butyl(dimethyl)silyl]oxy-2,3-bis(phenylmethoxy)butanal
SMILESCC(C)(C)[Si](C)(C)OC[C@H](OCc1ccccc1)[C@H](C=O)OCc1ccccc1
InChIInChI=1S/C24H34O4Si/c1-24(2,3)29(4,5)28-19-23(27-18-21-14-10-7-11-15-21)22(16-25)26-17-20-12-8-6-9-13-20/h6-16,22-23H,17-19H2,1-5H3/t22-,23-/m0/s1
InChIKeyFMKWWEWQTIRQKM-GOTSBHOMSA-N
XLogP5.38
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500414.62
LogP ≤ 55.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (2R,3S)-4-[tert-butyl(dimethyl)silyl]oxy-2,3-bis(phenylmethoxy)butanal 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

benzyl 2-[(2R,3R)-3-[tert-butyl(dimethyl)silyl]oxyoxan-2-yl]acetate
CID 12192987
benzyl 2-[[(2R,3R)-3-[tert-butyl(dimethyl)silyl]oxyoxan-2-yl]methoxy]acetate
CID 12192989
benzyl 2-[[(2R,3S)-3-[tert-butyl(dimethyl)silyl]oxyoxan-2-yl]methoxy]acetate
CID 44438932
4,5-Dideoxy-2,3-bis-O-(phenylmethyl)-L-threo-pent-4-enose
CID 11551099
(3S,4R)-3,4,5-tris(phenylmethoxy)pentan-2-one
CID 11729157
(2R,3S)-2,3-bis(methoxymethoxy)-4-phenylmethoxybutanal
CID 11077368
(2S)-2,3-bis(phenylmethoxy)propanal
CID 11254234
(2R,3S,4S,5R)-2,5-bis(phenylmethoxy)-3,4-bis(prop-2-enoxy)hexanedial
CID 134923017
1-O-benzyl 4-O-tert-butyl (2S)-2-[tert-butyl(dimethyl)silyl]oxybutanedioate
CID 10786824
(2R,3S,4S)-2,3,4-tris(benzyloxy)hex-5-enal
CID 10873429
(2S)-5-[tert-butyl(dimethyl)silyl]oxy-2-phenylmethoxypentanal
CID 11067249
(R)-2,3-Bis(benzyloxy)propanal
CID 11097604

Frequently Asked Questions

What is the IUPAC name of (2R,3S)-4-[tert-butyl(dimethyl)silyl]oxy-2,3-bis(phenylmethoxy)butanal?
The IUPAC name of (2R,3S)-4-[tert-butyl(dimethyl)silyl]oxy-2,3-bis(phenylmethoxy)butanal (CID 10364489) is (2R,3S)-4-[tert-butyl(dimethyl)silyl]oxy-2,3-bis(phenylmethoxy)butanal.
What is the SMILES notation for (2R,3S)-4-[tert-butyl(dimethyl)silyl]oxy-2,3-bis(phenylmethoxy)butanal?
The canonical SMILES for (2R,3S)-4-[tert-butyl(dimethyl)silyl]oxy-2,3-bis(phenylmethoxy)butanal is CC(C)(C)[Si](C)(C)OC[C@H](OCc1ccccc1)[C@H](C=O)OCc1ccccc1.
What is the InChIKey of (2R,3S)-4-[tert-butyl(dimethyl)silyl]oxy-2,3-bis(phenylmethoxy)butanal?
The InChIKey is FMKWWEWQTIRQKM-GOTSBHOMSA-N. The full InChI is InChI=1S/C24H34O4Si/c1-24(2,3)29(4,5)28-19-23(27-18-21-14-10-7-11-15-21)22(16-25)26-17-20-12-8-6-9-13-20/h6-16,22-23H,17-19H2,1-5H3/t22-,23-/m0/s1.
What are the key properties of (2R,3S)-4-[tert-butyl(dimethyl)silyl]oxy-2,3-bis(phenylmethoxy)butanal?
(2R,3S)-4-[tert-butyl(dimethyl)silyl]oxy-2,3-bis(phenylmethoxy)butanal has a molecular weight of 414.62 g/mol, XLogP of 5.38, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-4-[tert-butyl(dimethyl)silyl]oxy-2,3-bis(phenylmethoxy)butanal is sourced from PubChem (CID 10364489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).