tert-butyl-[5-(furan-3-yl)pentoxy]-diphenylsilane

C25H32O2Si — CID 11153578

IUPACtert-butyl-[5-(furan-3-yl)pentoxy]-diphenylsilane
SMILESCC(C)(C)[Si](OCCCCCc1ccoc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H32O2Si/c1-25(2,3)28(23-14-8-4-9-15-23,24-16-10-5-11-17-24)27-19-12-6-7-13-22-18-20-26-21-22/h4-5,8-11,14-18,20-21H,6-7,12-13,19H2,1-3H3
InChIKeyXYCXNTUUCCQRPC-UHFFFAOYSA-N
MW392.62 g/mol
LogP5.57
Rot. Bonds9

About tert-butyl-[5-(furan-3-yl)pentoxy]-diphenylsilane

tert-butyl-[5-(furan-3-yl)pentoxy]-diphenylsilane (PubChem CID 11153578) has the molecular formula C25H32O2Si and a molecular weight of 392.62 g/mol. Its IUPAC name is tert-butyl-[5-(furan-3-yl)pentoxy]-diphenylsilane.

Molecular Properties

Compound Nametert-butyl-[5-(furan-3-yl)pentoxy]-diphenylsilane
PubChem CID11153578
Molecular FormulaC25H32O2Si
Molecular Weight392.62 g/mol
Exact Mass392.22
IUPAC Nametert-butyl-[5-(furan-3-yl)pentoxy]-diphenylsilane
SMILESCC(C)(C)[Si](OCCCCCc1ccoc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H32O2Si/c1-25(2,3)28(23-14-8-4-9-15-23,24-16-10-5-11-17-24)27-19-12-6-7-13-22-18-20-26-21-22/h4-5,8-11,14-18,20-21H,6-7,12-13,19H2,1-3H3
InChIKeyXYCXNTUUCCQRPC-UHFFFAOYSA-N
XLogP5.57
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.62
LogP ≤ 55.57
H-Bond Donors ≤ 50
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

4-[4-[tert-butyl(diphenyl)silyl]oxybutyl]phenol
CID 102173956
tert-butyl-[3-(5-heptylfuran-2-yl)propoxy]-diphenylsilane
CID 140893830
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-(3-bromophenyl)butoxy-tert-butyl-diphenylsilane
CID 69439190
7-[tert-butyl(diphenyl)silyl]oxy-2-methylheptan-2-ol
CID 102173958
tert-butyl-diphenyl-tetradec-8-ynoxysilane
CID 90132306
tert-butyl-[3-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]propoxy]-diphenylsilane
CID 102246866
tert-butyl-diphenyl-undec-10-enoxysilane
CID 25058521
tert-butyl-diphenyl-(8-trityloxyoctoxy)silane
CID 102242281

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[5-(furan-3-yl)pentoxy]-diphenylsilane?
The IUPAC name of tert-butyl-[5-(furan-3-yl)pentoxy]-diphenylsilane (CID 11153578) is tert-butyl-[5-(furan-3-yl)pentoxy]-diphenylsilane.
What is the SMILES notation for tert-butyl-[5-(furan-3-yl)pentoxy]-diphenylsilane?
The canonical SMILES for tert-butyl-[5-(furan-3-yl)pentoxy]-diphenylsilane is CC(C)(C)[Si](OCCCCCc1ccoc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of tert-butyl-[5-(furan-3-yl)pentoxy]-diphenylsilane?
The InChIKey is XYCXNTUUCCQRPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32O2Si/c1-25(2,3)28(23-14-8-4-9-15-23,24-16-10-5-11-17-24)27-19-12-6-7-13-22-18-20-26-21-22/h4-5,8-11,14-18,20-21H,6-7,12-13,19H2,1-3H3.
What are the key properties of tert-butyl-[5-(furan-3-yl)pentoxy]-diphenylsilane?
tert-butyl-[5-(furan-3-yl)pentoxy]-diphenylsilane has a molecular weight of 392.62 g/mol, XLogP of 5.57, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[5-(furan-3-yl)pentoxy]-diphenylsilane is sourced from PubChem (CID 11153578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).