trimethyl-[2,2,2-trifluoro-1-[(2S,3R,4S,5S)-5-methoxy-3,4-bis(trimethylsilyloxy)oxolan-2-yl]-1-phenylmethoxyethoxy]silane

C23H41F3O6Si3 — CID 162411642

IUPACtrimethyl-[2,2,2-trifluoro-1-[(2S,3R,4S,5S)-5-methoxy-3,4-bis(trimethylsilyloxy)oxolan-2-yl]-1-phenylmethoxyethoxy]silane
SMILESCO[C@H]1O[C@H](C(OCc2ccccc2)(O[Si](C)(C)C)C(F)(F)F)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C
InChIInChI=1S/C23H41F3O6Si3/c1-27-21-19(31-34(5,6)7)18(30-33(2,3)4)20(29-21)22(23(24,25)26,32-35(8,9)10)28-16-17-14-12-11-13-15-17/h11-15,18-21H,16H2,1-10H3/t18-,19-,20-,21-,22?/m0/s1
InChIKeyOEQOFQRTDZRWBM-MMMKYPTOSA-N
MW554.83 g/mol
LogP6.12
Rot. Bonds11

About trimethyl-[2,2,2-trifluoro-1-[(2S,3R,4S,5S)-5-methoxy-3,4-bis(trimethylsilyloxy)oxolan-2-yl]-1-phenylmethoxyethoxy]silane

trimethyl-[2,2,2-trifluoro-1-[(2S,3R,4S,5S)-5-methoxy-3,4-bis(trimethylsilyloxy)oxolan-2-yl]-1-phenylmethoxyethoxy]silane (PubChem CID 162411642) has the molecular formula C23H41F3O6Si3 and a molecular weight of 554.83 g/mol. Its IUPAC name is trimethyl-[2,2,2-trifluoro-1-[(2S,3R,4S,5S)-5-methoxy-3,4-bis(trimethylsilyloxy)oxolan-2-yl]-1-phenylmethoxyethoxy]silane.

Molecular Properties

Compound Nametrimethyl-[2,2,2-trifluoro-1-[(2S,3R,4S,5S)-5-methoxy-3,4-bis(trimethylsilyloxy)oxolan-2-yl]-1-phenylmethoxyethoxy]silane
PubChem CID162411642
Molecular FormulaC23H41F3O6Si3
Molecular Weight554.83 g/mol
Exact Mass554.22
IUPAC Nametrimethyl-[2,2,2-trifluoro-1-[(2S,3R,4S,5S)-5-methoxy-3,4-bis(trimethylsilyloxy)oxolan-2-yl]-1-phenylmethoxyethoxy]silane
SMILESCO[C@H]1O[C@H](C(OCc2ccccc2)(O[Si](C)(C)C)C(F)(F)F)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C
InChIInChI=1S/C23H41F3O6Si3/c1-27-21-19(31-34(5,6)7)18(30-33(2,3)4)20(29-21)22(23(24,25)26,32-35(8,9)10)28-16-17-14-12-11-13-15-17/h11-15,18-21H,16H2,1-10H3/t18-,19-,20-,21-,22?/m0/s1
InChIKeyOEQOFQRTDZRWBM-MMMKYPTOSA-N
XLogP6.12
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms35
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500554.83
LogP ≤ 56.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze trimethyl-[2,2,2-trifluoro-1-[(2S,3R,4S,5S)-5-methoxy-3,4-bis(trimethylsilyloxy)oxolan-2-yl]-1-phenylmethoxyethoxy]silane 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

(4R)-4-[(1R)-2,2-difluoro-1-phenylmethoxybut-3-enyl]-2,2-dimethyl-1,3-dioxolane
CID 11277924
(2R,3R,4S,5S)-4-fluoro-5-methoxy-2-(phenylmethoxymethyl)oxolan-3-ol
CID 11832029
(4R)-4-(2,2-difluoro-1-phenylmethoxybut-3-enyl)-2,2-dimethyl-1,3-dioxolane
CID 12115894
[(2R,3R,4S,5R)-3-fluoro-5-methoxy-4-phenylmethoxyoxolan-2-yl]methanol
CID 13941341
1,6-anhydro-4-O-benzyl-3-deoxy-2-O-methyl-beta-D-ribo-hexopyranose
CID 67930855
(6-Allyloxy-3,4,5-tribenzyloxy-tetrahydropyran-2-yl)methoxy-tert-butyl-dimethyl-silane
CID 361712
(2R,4R)-4-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3,3-difluoro-4-phenylmethoxybutane-1,2-diol
CID 11461711
(2S)-4-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3,3-difluoro-4-phenylmethoxybutane-1,2-diol
CID 12115895
(2R)-4-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3,3-difluoro-4-phenylmethoxybutane-1,2-diol
CID 12115896
Bn(-2)[Tf(-3)][TBDMS(-5)]b-Xylf1Me
CID 13941339
(2S,3R,5S,6R)-5-fluoro-2-methoxy-6-methyl-3-phenylmethoxyoxane
CID 15000118
(3aS,5S,7S,7aS)-6,6-difluoro-2,2-dimethyl-5-(phenylmethoxymethyl)-3a,5,7,7a-tetrahydro-[1,3]dioxolo[4,5-b]pyran-7-ol
CID 101958480

Frequently Asked Questions

What is the IUPAC name of trimethyl-[2,2,2-trifluoro-1-[(2S,3R,4S,5S)-5-methoxy-3,4-bis(trimethylsilyloxy)oxolan-2-yl]-1-phenylmethoxyethoxy]silane?
The IUPAC name of trimethyl-[2,2,2-trifluoro-1-[(2S,3R,4S,5S)-5-methoxy-3,4-bis(trimethylsilyloxy)oxolan-2-yl]-1-phenylmethoxyethoxy]silane (CID 162411642) is trimethyl-[2,2,2-trifluoro-1-[(2S,3R,4S,5S)-5-methoxy-3,4-bis(trimethylsilyloxy)oxolan-2-yl]-1-phenylmethoxyethoxy]silane.
What is the SMILES notation for trimethyl-[2,2,2-trifluoro-1-[(2S,3R,4S,5S)-5-methoxy-3,4-bis(trimethylsilyloxy)oxolan-2-yl]-1-phenylmethoxyethoxy]silane?
The canonical SMILES for trimethyl-[2,2,2-trifluoro-1-[(2S,3R,4S,5S)-5-methoxy-3,4-bis(trimethylsilyloxy)oxolan-2-yl]-1-phenylmethoxyethoxy]silane is CO[C@H]1O[C@H](C(OCc2ccccc2)(O[Si](C)(C)C)C(F)(F)F)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C.
What is the InChIKey of trimethyl-[2,2,2-trifluoro-1-[(2S,3R,4S,5S)-5-methoxy-3,4-bis(trimethylsilyloxy)oxolan-2-yl]-1-phenylmethoxyethoxy]silane?
The InChIKey is OEQOFQRTDZRWBM-MMMKYPTOSA-N. The full InChI is InChI=1S/C23H41F3O6Si3/c1-27-21-19(31-34(5,6)7)18(30-33(2,3)4)20(29-21)22(23(24,25)26,32-35(8,9)10)28-16-17-14-12-11-13-15-17/h11-15,18-21H,16H2,1-10H3/t18-,19-,20-,21-,22?/m0/s1.
What are the key properties of trimethyl-[2,2,2-trifluoro-1-[(2S,3R,4S,5S)-5-methoxy-3,4-bis(trimethylsilyloxy)oxolan-2-yl]-1-phenylmethoxyethoxy]silane?
trimethyl-[2,2,2-trifluoro-1-[(2S,3R,4S,5S)-5-methoxy-3,4-bis(trimethylsilyloxy)oxolan-2-yl]-1-phenylmethoxyethoxy]silane has a molecular weight of 554.83 g/mol, XLogP of 6.12, 11 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2,2,2-trifluoro-1-[(2S,3R,4S,5S)-5-methoxy-3,4-bis(trimethylsilyloxy)oxolan-2-yl]-1-phenylmethoxyethoxy]silane is sourced from PubChem (CID 162411642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).