(5-fluoronaphthalen-2-yl)oxy-propan-2-yl-bis(2-trimethylsilylethyl)silane

C23H39FOSi3 — CID 173235779

IUPAC(5-fluoronaphthalen-2-yl)oxy-propan-2-yl-bis(2-trimethylsilylethyl)silane
SMILESCC(C)[Si](CC[Si](C)(C)C)(CC[Si](C)(C)C)Oc1ccc2c(F)cccc2c1
InChIInChI=1S/C23H39FOSi3/c1-19(2)28(16-14-26(3,4)5,17-15-27(6,7)8)25-21-12-13-22-20(18-21)10-9-11-23(22)24/h9-13,18-19H,14-17H2,1-8H3
InChIKeyODCPMKGCBOXHLY-UHFFFAOYSA-N
MW434.82 g/mol
LogP8.39
Rot. Bonds9

About (5-fluoronaphthalen-2-yl)oxy-propan-2-yl-bis(2-trimethylsilylethyl)silane

(5-fluoronaphthalen-2-yl)oxy-propan-2-yl-bis(2-trimethylsilylethyl)silane (PubChem CID 173235779) has the molecular formula C23H39FOSi3 and a molecular weight of 434.82 g/mol. Its IUPAC name is (5-fluoronaphthalen-2-yl)oxy-propan-2-yl-bis(2-trimethylsilylethyl)silane.

Molecular Properties

Compound Name(5-fluoronaphthalen-2-yl)oxy-propan-2-yl-bis(2-trimethylsilylethyl)silane
PubChem CID173235779
Molecular FormulaC23H39FOSi3
Molecular Weight434.82 g/mol
Exact Mass434.23
IUPAC Name(5-fluoronaphthalen-2-yl)oxy-propan-2-yl-bis(2-trimethylsilylethyl)silane
SMILESCC(C)[Si](CC[Si](C)(C)C)(CC[Si](C)(C)C)Oc1ccc2c(F)cccc2c1
InChIInChI=1S/C23H39FOSi3/c1-19(2)28(16-14-26(3,4)5,17-15-27(6,7)8)25-21-12-13-22-20(18-21)10-9-11-23(22)24/h9-13,18-19H,14-17H2,1-8H3
InChIKeyODCPMKGCBOXHLY-UHFFFAOYSA-N
XLogP8.39
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500434.82
LogP ≤ 58.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (5-fluoronaphthalen-2-yl)oxy-propan-2-yl-bis(2-trimethylsilylethyl)silane?
The IUPAC name of (5-fluoronaphthalen-2-yl)oxy-propan-2-yl-bis(2-trimethylsilylethyl)silane (CID 173235779) is (5-fluoronaphthalen-2-yl)oxy-propan-2-yl-bis(2-trimethylsilylethyl)silane.
What is the SMILES notation for (5-fluoronaphthalen-2-yl)oxy-propan-2-yl-bis(2-trimethylsilylethyl)silane?
The canonical SMILES for (5-fluoronaphthalen-2-yl)oxy-propan-2-yl-bis(2-trimethylsilylethyl)silane is CC(C)[Si](CC[Si](C)(C)C)(CC[Si](C)(C)C)Oc1ccc2c(F)cccc2c1.
What is the InChIKey of (5-fluoronaphthalen-2-yl)oxy-propan-2-yl-bis(2-trimethylsilylethyl)silane?
The InChIKey is ODCPMKGCBOXHLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H39FOSi3/c1-19(2)28(16-14-26(3,4)5,17-15-27(6,7)8)25-21-12-13-22-20(18-21)10-9-11-23(22)24/h9-13,18-19H,14-17H2,1-8H3.
What are the key properties of (5-fluoronaphthalen-2-yl)oxy-propan-2-yl-bis(2-trimethylsilylethyl)silane?
(5-fluoronaphthalen-2-yl)oxy-propan-2-yl-bis(2-trimethylsilylethyl)silane has a molecular weight of 434.82 g/mol, XLogP of 8.39, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoronaphthalen-2-yl)oxy-propan-2-yl-bis(2-trimethylsilylethyl)silane is sourced from PubChem (CID 173235779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).