1-benzhydrylsilylethyl formate

C16H18O2Si — CID 123160635

IUPAC1-benzhydrylsilylethyl formate
SMILESCC(OC=O)[SiH2]C(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H18O2Si/c1-13(18-12-17)19-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-13,16H,19H2,1H3
InChIKeyLHESDOVBULSSKM-UHFFFAOYSA-N
MW270.40 g/mol
LogP2.46
Rot. Bonds6

About 1-benzhydrylsilylethyl formate

1-benzhydrylsilylethyl formate (PubChem CID 123160635) has the molecular formula C16H18O2Si and a molecular weight of 270.40 g/mol. Its IUPAC name is 1-benzhydrylsilylethyl formate.

Molecular Properties

Compound Name1-benzhydrylsilylethyl formate
PubChem CID123160635
Molecular FormulaC16H18O2Si
Molecular Weight270.40 g/mol
Exact Mass270.11
IUPAC Name1-benzhydrylsilylethyl formate
SMILESCC(OC=O)[SiH2]C(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H18O2Si/c1-13(18-12-17)19-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-13,16H,19H2,1H3
InChIKeyLHESDOVBULSSKM-UHFFFAOYSA-N
XLogP2.46
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.40
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 76963066
[(1S)-2-amino-1-phenylpropyl] formate
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[methanesulfonamido(phenyl)methyl] formate
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1-phenyldodecyl formate
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1-phenylnonyl formate
CID 174585088
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[phenyl(propoxy)methyl] formate
CID 54315137
(3-methyl-1-phenylbut-3-enyl) formate
CID 143506419
1-methoxyethylbenzene;methyl formate;propane
CID 161186417
2-methyl-3-phenylbutanal
CID 3024886

Frequently Asked Questions

What is the IUPAC name of 1-benzhydrylsilylethyl formate?
The IUPAC name of 1-benzhydrylsilylethyl formate (CID 123160635) is 1-benzhydrylsilylethyl formate.
What is the SMILES notation for 1-benzhydrylsilylethyl formate?
The canonical SMILES for 1-benzhydrylsilylethyl formate is CC(OC=O)[SiH2]C(c1ccccc1)c1ccccc1.
What is the InChIKey of 1-benzhydrylsilylethyl formate?
The InChIKey is LHESDOVBULSSKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O2Si/c1-13(18-12-17)19-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-13,16H,19H2,1H3.
What are the key properties of 1-benzhydrylsilylethyl formate?
1-benzhydrylsilylethyl formate has a molecular weight of 270.40 g/mol, XLogP of 2.46, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzhydrylsilylethyl formate is sourced from PubChem (CID 123160635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).