5-(4-fluorophenyl)pentyl-hydroxy-di(propan-2-yl)silane

C17H29FOSi — CID 90171924

IUPAC5-(4-fluorophenyl)pentyl-hydroxy-di(propan-2-yl)silane
SMILESCC(C)[Si](O)(CCCCCc1ccc(F)cc1)C(C)C
InChIInChI=1S/C17H29FOSi/c1-14(2)20(19,15(3)4)13-7-5-6-8-16-9-11-17(18)12-10-16/h9-12,14-15,19H,5-8,13H2,1-4H3
InChIKeyNKIKBNCYICPCIQ-UHFFFAOYSA-N
MW296.50 g/mol
LogP5.30
Rot. Bonds8

About 5-(4-fluorophenyl)pentyl-hydroxy-di(propan-2-yl)silane

5-(4-fluorophenyl)pentyl-hydroxy-di(propan-2-yl)silane (PubChem CID 90171924) has the molecular formula C17H29FOSi and a molecular weight of 296.50 g/mol. Its IUPAC name is 5-(4-fluorophenyl)pentyl-hydroxy-di(propan-2-yl)silane.

Molecular Properties

Compound Name5-(4-fluorophenyl)pentyl-hydroxy-di(propan-2-yl)silane
PubChem CID90171924
Molecular FormulaC17H29FOSi
Molecular Weight296.50 g/mol
Exact Mass296.20
IUPAC Name5-(4-fluorophenyl)pentyl-hydroxy-di(propan-2-yl)silane
SMILESCC(C)[Si](O)(CCCCCc1ccc(F)cc1)C(C)C
InChIInChI=1S/C17H29FOSi/c1-14(2)20(19,15(3)4)13-7-5-6-8-16-9-11-17(18)12-10-16/h9-12,14-15,19H,5-8,13H2,1-4H3
InChIKeyNKIKBNCYICPCIQ-UHFFFAOYSA-N
XLogP5.30
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500296.50
LogP ≤ 55.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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-(3,5-difluorophenyl)butyl-hydroxy-di(propan-2-yl)silane
CID 90171446
hydroxy-[7-(2,3,4,5,6-pentafluorophenyl)heptyl]-di(propan-2-yl)silane
CID 90171678
6-(4-fluorophenyl)hexyl-methoxy-di(propan-2-yloxy)silane
CID 90174604
[5-(4-fluorophenyl)pentyl-di(propanoyloxy)silyl] propanoate
CID 90170475
diethoxy-[4-(4-fluorophenyl)butyl]-methylsilane
CID 90171092
1-(5-chloropentyl)-4-fluorobenzene
CID 57030730
6-(4-fluorophenyl)hexan-1-amine
CID 18470415
[4-(4-fluorophenyl)butyl-di(propanoyloxy)silyl] propanoate
CID 90174752
1-fluoro-4-[5-[5-(4-fluorophenyl)pentylsulfanyl]pentyl]benzene
CID 164522960
6-(4-fluorophenyl)hexanoic acid
CID 14739735
11-(4-fluorophenyl)undecanamide
CID 144640590
[(2R)-4-(4-fluorophenyl)butan-2-yl]azanium
CID 7449312

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)pentyl-hydroxy-di(propan-2-yl)silane?
The IUPAC name of 5-(4-fluorophenyl)pentyl-hydroxy-di(propan-2-yl)silane (CID 90171924) is 5-(4-fluorophenyl)pentyl-hydroxy-di(propan-2-yl)silane.
What is the SMILES notation for 5-(4-fluorophenyl)pentyl-hydroxy-di(propan-2-yl)silane?
The canonical SMILES for 5-(4-fluorophenyl)pentyl-hydroxy-di(propan-2-yl)silane is CC(C)[Si](O)(CCCCCc1ccc(F)cc1)C(C)C.
What is the InChIKey of 5-(4-fluorophenyl)pentyl-hydroxy-di(propan-2-yl)silane?
The InChIKey is NKIKBNCYICPCIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29FOSi/c1-14(2)20(19,15(3)4)13-7-5-6-8-16-9-11-17(18)12-10-16/h9-12,14-15,19H,5-8,13H2,1-4H3.
What are the key properties of 5-(4-fluorophenyl)pentyl-hydroxy-di(propan-2-yl)silane?
5-(4-fluorophenyl)pentyl-hydroxy-di(propan-2-yl)silane has a molecular weight of 296.50 g/mol, XLogP of 5.30, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)pentyl-hydroxy-di(propan-2-yl)silane is sourced from PubChem (CID 90171924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).