2-aminoethanol;methoxy-bis[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane

C25H37NO6Si3 — CID 90659486

IUPAC2-aminoethanol;methoxy-bis[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane
SMILESCO[Si](C)(O[Si](OC)(O[Si](C)(OC)c1ccccc1)c1ccccc1)c1ccccc1.NCCO
InChIInChI=1S/C23H30O5Si3.C2H7NO/c1-24-29(4,21-15-9-6-10-16-21)27-31(26-3,23-19-13-8-14-20-23)28-30(5,25-2)22-17-11-7-12-18-22;3-1-2-4/h6-20H,1-5H3;4H,1-3H2
InChIKeyPWLYTRNYSPOQAZ-UHFFFAOYSA-N
MW531.83 g/mol
LogP1.70
Rot. Bonds11

About 2-aminoethanol;methoxy-bis[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane

2-aminoethanol;methoxy-bis[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane (PubChem CID 90659486) has the molecular formula C25H37NO6Si3 and a molecular weight of 531.83 g/mol. Its IUPAC name is 2-aminoethanol;methoxy-bis[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane.

Molecular Properties

Compound Name2-aminoethanol;methoxy-bis[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane
PubChem CID90659486
Molecular FormulaC25H37NO6Si3
Molecular Weight531.83 g/mol
Exact Mass531.19
IUPAC Name2-aminoethanol;methoxy-bis[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane
SMILESCO[Si](C)(O[Si](OC)(O[Si](C)(OC)c1ccccc1)c1ccccc1)c1ccccc1.NCCO
InChIInChI=1S/C23H30O5Si3.C2H7NO/c1-24-29(4,21-15-9-6-10-16-21)27-31(26-3,23-19-13-8-14-20-23)28-30(5,25-2)22-17-11-7-12-18-22;3-1-2-4/h6-20H,1-5H3;4H,1-3H2
InChIKeyPWLYTRNYSPOQAZ-UHFFFAOYSA-N
XLogP1.70
TPSA92.40 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds11
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500531.83
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

Diethoxy(dimethyl)silane;triethoxy(phenyl)silane;3-triethoxysilylpropan-1-amine
CID 6455506
2-(t-Butyldiphenylsilyloxy)ethylamine
CID 11001043
(2S)-2-Amino-3-{[tert-butyl(diphenyl)silyl]oxy}propan-1-ol
CID 71362476
3,3'-(1,5-Bis(3-aminopropoxy)-3,3-diphenyl-1,5-diethoxytrisiloxane-1,5-diyl)bis-(propane-1-amine)
CID 172053498
1,5-Bis-(3-aminopropyl)-1,1,5,5-tetraethoxy-3,3-diphenyltrisiloxane
CID 172907447
3,3'-(3,3-Diphenyl-1,1,5,5-tetramethoxytrisiloxane-1,5-diyl)bis-(propan-1-amine)
CID 176469666
Bis-[(3-aminopropyl)diethoxysilyl]diphenylsilane
CID 172907440
Bis-[bis-(3-aminopropyloxy)(3-aminopropyl)silyl]diphen ylsilane
CID 172907475
2-[2-[Tert-butyl(diphenyl)silyl]oxyethylamino]ethanol
CID 20591828
3-[Diethoxy(phenyl)silyl]propan-1-amine;1-triethoxysilylbutan-1-amine
CID 21428433
Tributoxy(phenyl)silane;1-triethoxysilylpropan-1-amine
CID 21640049
Bis[4-aminobutyl(diphenyl)silyl] dimethyl silicate
CID 21739278

Frequently Asked Questions

What is the IUPAC name of 2-aminoethanol;methoxy-bis[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane?
The IUPAC name of 2-aminoethanol;methoxy-bis[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane (CID 90659486) is 2-aminoethanol;methoxy-bis[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane.
What is the SMILES notation for 2-aminoethanol;methoxy-bis[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane?
The canonical SMILES for 2-aminoethanol;methoxy-bis[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane is CO[Si](C)(O[Si](OC)(O[Si](C)(OC)c1ccccc1)c1ccccc1)c1ccccc1.NCCO.
What is the InChIKey of 2-aminoethanol;methoxy-bis[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane?
The InChIKey is PWLYTRNYSPOQAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30O5Si3.C2H7NO/c1-24-29(4,21-15-9-6-10-16-21)27-31(26-3,23-19-13-8-14-20-23)28-30(5,25-2)22-17-11-7-12-18-22;3-1-2-4/h6-20H,1-5H3;4H,1-3H2.
What are the key properties of 2-aminoethanol;methoxy-bis[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane?
2-aminoethanol;methoxy-bis[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane has a molecular weight of 531.83 g/mol, XLogP of 1.70, 11 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoethanol;methoxy-bis[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane is sourced from PubChem (CID 90659486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).