7-[tert-butyl(diphenyl)silyl]oxy-2-methylheptan-2-ol

C24H36O2Si — CID 102173958

IUPAC7-[tert-butyl(diphenyl)silyl]oxy-2-methylheptan-2-ol
SMILESCC(C)(O)CCCCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C24H36O2Si/c1-23(2,3)27(21-15-9-6-10-16-21,22-17-11-7-12-18-22)26-20-14-8-13-19-24(4,5)25/h6-7,9-12,15-18,25H,8,13-14,19-20H2,1-5H3
InChIKeyWUBYZXDVKAOUBJ-UHFFFAOYSA-N
MW384.64 g/mol
LogP4.89
Rot. Bonds9

About 7-[tert-butyl(diphenyl)silyl]oxy-2-methylheptan-2-ol

7-[tert-butyl(diphenyl)silyl]oxy-2-methylheptan-2-ol (PubChem CID 102173958) has the molecular formula C24H36O2Si and a molecular weight of 384.64 g/mol. Its IUPAC name is 7-[tert-butyl(diphenyl)silyl]oxy-2-methylheptan-2-ol.

Molecular Properties

Compound Name7-[tert-butyl(diphenyl)silyl]oxy-2-methylheptan-2-ol
PubChem CID102173958
Molecular FormulaC24H36O2Si
Molecular Weight384.64 g/mol
Exact Mass384.25
IUPAC Name7-[tert-butyl(diphenyl)silyl]oxy-2-methylheptan-2-ol
SMILESCC(C)(O)CCCCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C24H36O2Si/c1-23(2,3)27(21-15-9-6-10-16-21,22-17-11-7-12-18-22)26-20-14-8-13-19-24(4,5)25/h6-7,9-12,15-18,25H,8,13-14,19-20H2,1-5H3
InChIKeyWUBYZXDVKAOUBJ-UHFFFAOYSA-N
XLogP4.89
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.64
LogP ≤ 54.89
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

12-[tert-butyl(diphenyl)silyl]oxydodecan-1-ol
CID 11015684
tert-butyl-(10-iododecoxy)-diphenylsilane
CID 10994946
tert-butyl-(5-iodopentoxy)-diphenylsilane
CID 10003991
8-bromooctoxy-tert-butyl-diphenylsilane
CID 22444390
4-[tert-butyl(diphenyl)silyl]oxy-1,1-diphenylbutan-1-ol
CID 165343479
tert-butyl-[6-(methoxymethoxy)-6-methylheptoxy]-diphenylsilane
CID 102173957
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
tert-butyl-diphenyl-(8-trityloxyoctoxy)silane
CID 102242281
3-bromopropoxy-tert-butyl-diphenylsilane
CID 11245865
(Z)-11-[tert-butyl(diphenyl)silyl]oxyundec-5-en-1-ol
CID 90098390

Frequently Asked Questions

What is the IUPAC name of 7-[tert-butyl(diphenyl)silyl]oxy-2-methylheptan-2-ol?
The IUPAC name of 7-[tert-butyl(diphenyl)silyl]oxy-2-methylheptan-2-ol (CID 102173958) is 7-[tert-butyl(diphenyl)silyl]oxy-2-methylheptan-2-ol.
What is the SMILES notation for 7-[tert-butyl(diphenyl)silyl]oxy-2-methylheptan-2-ol?
The canonical SMILES for 7-[tert-butyl(diphenyl)silyl]oxy-2-methylheptan-2-ol is CC(C)(O)CCCCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.
What is the InChIKey of 7-[tert-butyl(diphenyl)silyl]oxy-2-methylheptan-2-ol?
The InChIKey is WUBYZXDVKAOUBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H36O2Si/c1-23(2,3)27(21-15-9-6-10-16-21,22-17-11-7-12-18-22)26-20-14-8-13-19-24(4,5)25/h6-7,9-12,15-18,25H,8,13-14,19-20H2,1-5H3.
What are the key properties of 7-[tert-butyl(diphenyl)silyl]oxy-2-methylheptan-2-ol?
7-[tert-butyl(diphenyl)silyl]oxy-2-methylheptan-2-ol has a molecular weight of 384.64 g/mol, XLogP of 4.89, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[tert-butyl(diphenyl)silyl]oxy-2-methylheptan-2-ol is sourced from PubChem (CID 102173958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).