2-(3-trimethylsilyloxyphenyl)acetic acid

C11H16O3Si — CID 167737399

IUPAC2-(3-trimethylsilyloxyphenyl)acetic acid
SMILESC[Si](C)(C)Oc1cccc(CC(=O)O)c1
InChIInChI=1S/C11H16O3Si/c1-15(2,3)14-10-6-4-5-9(7-10)8-11(12)13/h4-7H,8H2,1-3H3,(H,12,13)
InChIKeySSXSRLUVQOGCLV-UHFFFAOYSA-N
MW224.33 g/mol
LogP2.53
Rot. Bonds4

About 2-(3-trimethylsilyloxyphenyl)acetic acid

2-(3-trimethylsilyloxyphenyl)acetic acid (PubChem CID 167737399) has the molecular formula C11H16O3Si and a molecular weight of 224.33 g/mol. Its IUPAC name is 2-(3-trimethylsilyloxyphenyl)acetic acid.

Molecular Properties

Compound Name2-(3-trimethylsilyloxyphenyl)acetic acid
PubChem CID167737399
Molecular FormulaC11H16O3Si
Molecular Weight224.33 g/mol
Exact Mass224.09
IUPAC Name2-(3-trimethylsilyloxyphenyl)acetic acid
SMILESC[Si](C)(C)Oc1cccc(CC(=O)O)c1
InChIInChI=1S/C11H16O3Si/c1-15(2,3)14-10-6-4-5-9(7-10)8-11(12)13/h4-7H,8H2,1-3H3,(H,12,13)
InChIKeySSXSRLUVQOGCLV-UHFFFAOYSA-N
XLogP2.53
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(3-fluorooxyphenyl)acetic acid
CID 69494655
2-[3-(3-methoxyphenoxy)phenyl]acetic acid
CID 19421788
2-[3-(bromomethoxy)phenyl]acetic acid
CID 151200250
2-(3-ethenoxyphenyl)acetic acid
CID 88995868
2-[3-(ethoxymethoxy)phenyl]acetic acid
CID 65364927
2-[3-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]acetic acid
CID 61398198
2-[3-(2-chloroacetyl)oxyphenyl]acetic acid
CID 56620307
2-(3-octoxyphenyl)acetic acid
CID 11975056
2-[3-(2-phenylpropan-2-yloxy)phenyl]acetic acid
CID 69488903
2-[3-(2-fluoro-2-methylpropoxy)phenyl]acetic acid
CID 84690473
2-[3-(ethylcarbamoyloxy)phenyl]acetic acid
CID 144799433
2-[3-(2,2-difluoropropoxy)phenyl]acetic acid
CID 84693368

Frequently Asked Questions

What is the IUPAC name of 2-(3-trimethylsilyloxyphenyl)acetic acid?
The IUPAC name of 2-(3-trimethylsilyloxyphenyl)acetic acid (CID 167737399) is 2-(3-trimethylsilyloxyphenyl)acetic acid.
What is the SMILES notation for 2-(3-trimethylsilyloxyphenyl)acetic acid?
The canonical SMILES for 2-(3-trimethylsilyloxyphenyl)acetic acid is C[Si](C)(C)Oc1cccc(CC(=O)O)c1.
What is the InChIKey of 2-(3-trimethylsilyloxyphenyl)acetic acid?
The InChIKey is SSXSRLUVQOGCLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O3Si/c1-15(2,3)14-10-6-4-5-9(7-10)8-11(12)13/h4-7H,8H2,1-3H3,(H,12,13).
What are the key properties of 2-(3-trimethylsilyloxyphenyl)acetic acid?
2-(3-trimethylsilyloxyphenyl)acetic acid has a molecular weight of 224.33 g/mol, XLogP of 2.53, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-trimethylsilyloxyphenyl)acetic acid is sourced from PubChem (CID 167737399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).