pentan-3-yloxy-[4-(1-phenylethenyl)phenyl]silane

C19H24OSi — CID 175159839

IUPACpentan-3-yloxy-[4-(1-phenylethenyl)phenyl]silane
SMILESC=C(c1ccccc1)c1ccc([SiH2]OC(CC)CC)cc1
InChIInChI=1S/C19H24OSi/c1-4-18(5-2)20-21-19-13-11-17(12-14-19)15(3)16-9-7-6-8-10-16/h6-14,18H,3-5,21H2,1-2H3
InChIKeyGGUSWGOZWLPHAQ-UHFFFAOYSA-N
MW296.49 g/mol
LogP3.66
Rot. Bonds7

About pentan-3-yloxy-[4-(1-phenylethenyl)phenyl]silane

pentan-3-yloxy-[4-(1-phenylethenyl)phenyl]silane (PubChem CID 175159839) has the molecular formula C19H24OSi and a molecular weight of 296.49 g/mol. Its IUPAC name is pentan-3-yloxy-[4-(1-phenylethenyl)phenyl]silane.

Molecular Properties

Compound Namepentan-3-yloxy-[4-(1-phenylethenyl)phenyl]silane
PubChem CID175159839
Molecular FormulaC19H24OSi
Molecular Weight296.49 g/mol
Exact Mass296.16
IUPAC Namepentan-3-yloxy-[4-(1-phenylethenyl)phenyl]silane
SMILESC=C(c1ccccc1)c1ccc([SiH2]OC(CC)CC)cc1
InChIInChI=1S/C19H24OSi/c1-4-18(5-2)20-21-19-13-11-17(12-14-19)15(3)16-9-7-6-8-10-16/h6-14,18H,3-5,21H2,1-2H3
InChIKeyGGUSWGOZWLPHAQ-UHFFFAOYSA-N
XLogP3.66
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.49
LogP ≤ 53.66
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 pentan-3-yloxy-[4-(1-phenylethenyl)phenyl]silane?
The IUPAC name of pentan-3-yloxy-[4-(1-phenylethenyl)phenyl]silane (CID 175159839) is pentan-3-yloxy-[4-(1-phenylethenyl)phenyl]silane.
What is the SMILES notation for pentan-3-yloxy-[4-(1-phenylethenyl)phenyl]silane?
The canonical SMILES for pentan-3-yloxy-[4-(1-phenylethenyl)phenyl]silane is C=C(c1ccccc1)c1ccc([SiH2]OC(CC)CC)cc1.
What is the InChIKey of pentan-3-yloxy-[4-(1-phenylethenyl)phenyl]silane?
The InChIKey is GGUSWGOZWLPHAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24OSi/c1-4-18(5-2)20-21-19-13-11-17(12-14-19)15(3)16-9-7-6-8-10-16/h6-14,18H,3-5,21H2,1-2H3.
What are the key properties of pentan-3-yloxy-[4-(1-phenylethenyl)phenyl]silane?
pentan-3-yloxy-[4-(1-phenylethenyl)phenyl]silane has a molecular weight of 296.49 g/mol, XLogP of 3.66, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for pentan-3-yloxy-[4-(1-phenylethenyl)phenyl]silane is sourced from PubChem (CID 175159839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).