(Z)-8-[tert-butyl(diphenyl)silyl]oxy-3-fluorooct-3-en-1-ol

C24H33FO2Si — CID 23054616

IUPAC(Z)-8-[tert-butyl(diphenyl)silyl]oxy-3-fluorooct-3-en-1-ol
SMILESCC(C)(C)[Si](OCCCC/C=C(\F)CCO)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H33FO2Si/c1-24(2,3)28(22-14-8-4-9-15-22,23-16-10-5-11-17-23)27-20-12-6-7-13-21(25)18-19-26/h4-5,8-11,13-17,26H,6-7,12,18-20H2,1-3H3/b21-13-
InChIKeyWEQBAUJLUFOGRP-BKUYFWCQSA-N
MW400.61 g/mol
LogP4.97
Rot. Bonds10

About (Z)-8-[tert-butyl(diphenyl)silyl]oxy-3-fluorooct-3-en-1-ol

(Z)-8-[tert-butyl(diphenyl)silyl]oxy-3-fluorooct-3-en-1-ol (PubChem CID 23054616) has the molecular formula C24H33FO2Si and a molecular weight of 400.61 g/mol. Its IUPAC name is (Z)-8-[tert-butyl(diphenyl)silyl]oxy-3-fluorooct-3-en-1-ol.

Molecular Properties

Compound Name(Z)-8-[tert-butyl(diphenyl)silyl]oxy-3-fluorooct-3-en-1-ol
PubChem CID23054616
Molecular FormulaC24H33FO2Si
Molecular Weight400.61 g/mol
Exact Mass400.22
IUPAC Name(Z)-8-[tert-butyl(diphenyl)silyl]oxy-3-fluorooct-3-en-1-ol
SMILESCC(C)(C)[Si](OCCCC/C=C(\F)CCO)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H33FO2Si/c1-24(2,3)28(22-14-8-4-9-15-22,23-16-10-5-11-17-23)27-20-12-6-7-13-21(25)18-19-26/h4-5,8-11,13-17,26H,6-7,12,18-20H2,1-3H3/b21-13-
InChIKeyWEQBAUJLUFOGRP-BKUYFWCQSA-N
XLogP4.97
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.61
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(Z)-11-[tert-butyl(diphenyl)silyl]oxyundec-5-en-1-ol
CID 90098390
12-[tert-butyl(diphenyl)silyl]oxydodecan-1-ol
CID 11015684
tert-butyl-[(5Z,8Z,11E,14E)-6,9-difluoroicosa-5,8,11,14-tetraenoxy]-diphenylsilane
CID 23168652
3-[tert-butyl(diphenyl)silyl]oxypropan-1-ol;propane-1,3-diol
CID 161331009
2-[4-[tert-butyl(diphenyl)silyl]oxybutoxy]ethanol
CID 156707018
tert-butyl-diphenyl-undec-10-enoxysilane
CID 25058521
methyl (E)-7-[tert-butyl(diphenyl)silyl]oxy-2-methylhept-2-enoate
CID 10319406
tert-butyl-[(E)-dec-5-enoxy]-diphenylsilane
CID 11188599
4-[tert-butyl(diphenyl)silyl]oxy-2-fluorobut-2-en-1-ol
CID 66982894
7-[tert-butyl(diphenyl)silyl]oxy-2-methylheptan-2-ol
CID 102173958
(E)-5-[tert-butyl(diphenyl)silyl]oxy-3-methylpent-2-en-1-ol
CID 135030069
tert-butyl-heptatriaconta-23,26-dienoxy-diphenylsilane
CID 69009078

Frequently Asked Questions

What is the IUPAC name of (Z)-8-[tert-butyl(diphenyl)silyl]oxy-3-fluorooct-3-en-1-ol?
The IUPAC name of (Z)-8-[tert-butyl(diphenyl)silyl]oxy-3-fluorooct-3-en-1-ol (CID 23054616) is (Z)-8-[tert-butyl(diphenyl)silyl]oxy-3-fluorooct-3-en-1-ol.
What is the SMILES notation for (Z)-8-[tert-butyl(diphenyl)silyl]oxy-3-fluorooct-3-en-1-ol?
The canonical SMILES for (Z)-8-[tert-butyl(diphenyl)silyl]oxy-3-fluorooct-3-en-1-ol is CC(C)(C)[Si](OCCCC/C=C(\F)CCO)(c1ccccc1)c1ccccc1.
What is the InChIKey of (Z)-8-[tert-butyl(diphenyl)silyl]oxy-3-fluorooct-3-en-1-ol?
The InChIKey is WEQBAUJLUFOGRP-BKUYFWCQSA-N. The full InChI is InChI=1S/C24H33FO2Si/c1-24(2,3)28(22-14-8-4-9-15-22,23-16-10-5-11-17-23)27-20-12-6-7-13-21(25)18-19-26/h4-5,8-11,13-17,26H,6-7,12,18-20H2,1-3H3/b21-13-.
What are the key properties of (Z)-8-[tert-butyl(diphenyl)silyl]oxy-3-fluorooct-3-en-1-ol?
(Z)-8-[tert-butyl(diphenyl)silyl]oxy-3-fluorooct-3-en-1-ol has a molecular weight of 400.61 g/mol, XLogP of 4.97, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-8-[tert-butyl(diphenyl)silyl]oxy-3-fluorooct-3-en-1-ol is sourced from PubChem (CID 23054616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).