dimethyl-pentoxy-(2-phenylphenoxy)silane

C19H26O2Si — CID 91734401

IUPACdimethyl-pentoxy-(2-phenylphenoxy)silane
SMILESCCCCCO[Si](C)(C)Oc1ccccc1-c1ccccc1
InChIInChI=1S/C19H26O2Si/c1-4-5-11-16-20-22(2,3)21-19-15-10-9-14-18(19)17-12-7-6-8-13-17/h6-10,12-15H,4-5,11,16H2,1-3H3
InChIKeyQDYMRDPISUHVNI-UHFFFAOYSA-N
MW314.50 g/mol
LogP5.64
Rot. Bonds8

About dimethyl-pentoxy-(2-phenylphenoxy)silane

dimethyl-pentoxy-(2-phenylphenoxy)silane (PubChem CID 91734401) has the molecular formula C19H26O2Si and a molecular weight of 314.50 g/mol. Its IUPAC name is dimethyl-pentoxy-(2-phenylphenoxy)silane.

Molecular Properties

Compound Namedimethyl-pentoxy-(2-phenylphenoxy)silane
PubChem CID91734401
Molecular FormulaC19H26O2Si
Molecular Weight314.50 g/mol
Exact Mass314.17
IUPAC Namedimethyl-pentoxy-(2-phenylphenoxy)silane
SMILESCCCCCO[Si](C)(C)Oc1ccccc1-c1ccccc1
InChIInChI=1S/C19H26O2Si/c1-4-5-11-16-20-22(2,3)21-19-15-10-9-14-18(19)17-12-7-6-8-13-17/h6-10,12-15H,4-5,11,16H2,1-3H3
InChIKeyQDYMRDPISUHVNI-UHFFFAOYSA-N
XLogP5.64
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.50
LogP ≤ 55.64
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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Frequently Asked Questions

What is the IUPAC name of dimethyl-pentoxy-(2-phenylphenoxy)silane?
The IUPAC name of dimethyl-pentoxy-(2-phenylphenoxy)silane (CID 91734401) is dimethyl-pentoxy-(2-phenylphenoxy)silane.
What is the SMILES notation for dimethyl-pentoxy-(2-phenylphenoxy)silane?
The canonical SMILES for dimethyl-pentoxy-(2-phenylphenoxy)silane is CCCCCO[Si](C)(C)Oc1ccccc1-c1ccccc1.
What is the InChIKey of dimethyl-pentoxy-(2-phenylphenoxy)silane?
The InChIKey is QDYMRDPISUHVNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26O2Si/c1-4-5-11-16-20-22(2,3)21-19-15-10-9-14-18(19)17-12-7-6-8-13-17/h6-10,12-15H,4-5,11,16H2,1-3H3.
What are the key properties of dimethyl-pentoxy-(2-phenylphenoxy)silane?
dimethyl-pentoxy-(2-phenylphenoxy)silane has a molecular weight of 314.50 g/mol, XLogP of 5.64, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-pentoxy-(2-phenylphenoxy)silane is sourced from PubChem (CID 91734401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).