2,2-bis[[tert-butyl(dimethyl)silyl]oxymethyl]propane-1,3-diol

C17H40O4Si2 — CID 86030000

IUPAC2,2-bis[[tert-butyl(dimethyl)silyl]oxymethyl]propane-1,3-diol
SMILESCC(C)(C)[Si](C)(C)OCC(CO)(CO)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H40O4Si2/c1-15(2,3)22(7,8)20-13-17(11-18,12-19)14-21-23(9,10)16(4,5)6/h18-19H,11-14H2,1-10H3
InChIKeyPVZAPNKNGMWSFZ-UHFFFAOYSA-N
MW364.68 g/mol
LogP4.00
Rot. Bonds8

About 2,2-bis[[tert-butyl(dimethyl)silyl]oxymethyl]propane-1,3-diol

2,2-bis[[tert-butyl(dimethyl)silyl]oxymethyl]propane-1,3-diol (PubChem CID 86030000) has the molecular formula C17H40O4Si2 and a molecular weight of 364.68 g/mol. Its IUPAC name is 2,2-bis[[tert-butyl(dimethyl)silyl]oxymethyl]propane-1,3-diol.

Molecular Properties

Compound Name2,2-bis[[tert-butyl(dimethyl)silyl]oxymethyl]propane-1,3-diol
PubChem CID86030000
Molecular FormulaC17H40O4Si2
Molecular Weight364.68 g/mol
Exact Mass364.25
IUPAC Name2,2-bis[[tert-butyl(dimethyl)silyl]oxymethyl]propane-1,3-diol
SMILESCC(C)(C)[Si](C)(C)OCC(CO)(CO)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H40O4Si2/c1-15(2,3)22(7,8)20-13-17(11-18,12-19)14-21-23(9,10)16(4,5)6/h18-19H,11-14H2,1-10H3
InChIKeyPVZAPNKNGMWSFZ-UHFFFAOYSA-N
XLogP4.00
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.68
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[(Tert-butyldimethylsilyl)oxy]propan-1-ol
CID 4077791
2,2,8,8-Tetramethyl-5,5-bis(((trimethylsilyl)oxy)methyl)-3,7-dioxa-2,8-disilanonane
CID 529479
3,3'-(1,1,3,3,5,5-Hexamethyltrisiloxane-1,5-diyl)di(propan-1-ol)
CID 14323165
C19H46O5Si3
CID 20702526
2,2-Dimethylpropane-1,3-diol, O,O-bis(tert-butyldimethylsilyl)-ether
CID 87775663
3-[Tris(trimethylsiloxy)silyl]propyl alcohol
CID 22677150
Poly[oxy(dimethylsilylene)], I+/--[(4-hydroxybutyl)dimethylsilyl]-I-[[(4-hydroxybutyl)dimethylsilyl]oxy]-
CID 57605721
Poly[oxy(dimethylsilylene)], I+/--[[3-[2,2-bis(hydroxymethyl)butoxy]propyl]dimethylsilyl]-I-[(trimethylsilyl)oxy]-
CID 59222460
Dibutoxybis(triethylsiloxy)titanium
CID 129802264
2-Ethyl-2-((3-(1,3,3,3-tetramethyl1-((trimethylsilyl)oxy)-1-disiloxanyl)propoxy)methyl)-1,3propanediol
CID 140891438
3-[[Dimethyl(trimethylsilyloxy)silyl]oxy-methyl-trimethylsilyloxysilyl]propan-1-ol
CID 23524549
Trimethylolpropane, 2TBDMS derivative
CID 91726205

Frequently Asked Questions

What is the IUPAC name of 2,2-bis[[tert-butyl(dimethyl)silyl]oxymethyl]propane-1,3-diol?
The IUPAC name of 2,2-bis[[tert-butyl(dimethyl)silyl]oxymethyl]propane-1,3-diol (CID 86030000) is 2,2-bis[[tert-butyl(dimethyl)silyl]oxymethyl]propane-1,3-diol.
What is the SMILES notation for 2,2-bis[[tert-butyl(dimethyl)silyl]oxymethyl]propane-1,3-diol?
The canonical SMILES for 2,2-bis[[tert-butyl(dimethyl)silyl]oxymethyl]propane-1,3-diol is CC(C)(C)[Si](C)(C)OCC(CO)(CO)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of 2,2-bis[[tert-butyl(dimethyl)silyl]oxymethyl]propane-1,3-diol?
The InChIKey is PVZAPNKNGMWSFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H40O4Si2/c1-15(2,3)22(7,8)20-13-17(11-18,12-19)14-21-23(9,10)16(4,5)6/h18-19H,11-14H2,1-10H3.
What are the key properties of 2,2-bis[[tert-butyl(dimethyl)silyl]oxymethyl]propane-1,3-diol?
2,2-bis[[tert-butyl(dimethyl)silyl]oxymethyl]propane-1,3-diol has a molecular weight of 364.68 g/mol, XLogP of 4.00, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-bis[[tert-butyl(dimethyl)silyl]oxymethyl]propane-1,3-diol is sourced from PubChem (CID 86030000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).