2-propan-2-yloxysilylpropanoic acid

C6H14O3Si — CID 175048913

IUPAC2-propan-2-yloxysilylpropanoic acid
SMILESCC(C)O[SiH2]C(C)C(=O)O
InChIInChI=1S/C6H14O3Si/c1-4(2)9-10-5(3)6(7)8/h4-5H,10H2,1-3H3,(H,7,8)
InChIKeyMQQCMKHMPJWWKQ-UHFFFAOYSA-N
MW162.26 g/mol
LogP0.39
Rot. Bonds4

About 2-propan-2-yloxysilylpropanoic acid

2-propan-2-yloxysilylpropanoic acid (PubChem CID 175048913) has the molecular formula C6H14O3Si and a molecular weight of 162.26 g/mol. Its IUPAC name is 2-propan-2-yloxysilylpropanoic acid.

Molecular Properties

Compound Name2-propan-2-yloxysilylpropanoic acid
PubChem CID175048913
Molecular FormulaC6H14O3Si
Molecular Weight162.26 g/mol
Exact Mass162.07
IUPAC Name2-propan-2-yloxysilylpropanoic acid
SMILESCC(C)O[SiH2]C(C)C(=O)O
InChIInChI=1S/C6H14O3Si/c1-4(2)9-10-5(3)6(7)8/h4-5H,10H2,1-3H3,(H,7,8)
InChIKeyMQQCMKHMPJWWKQ-UHFFFAOYSA-N
XLogP0.39
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.26
LogP ≤ 50.39
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

propan-2-yl(propan-2-yloxy)silane
CID 123565632
2-methylpropanoic acid;ruthenium
CID 88674751
2-methylpropanoic acid
CID 173073412
carbonic acid;2-propan-2-yloxypropane
CID 158018053
carbonic acid;2-propan-2-ylperoxypropane
CID 87099800
2-hydroxypropanoic acid
CID 87075455
azane;2-methylpropanoic acid;hydrate
CID 161320294
alumane;2-methylpropanoic acid
CID 173068323
cerium;tris(2-methylpropanoic acid)
CID 153360547
methanol;2-methylpropanoic acid
CID 159214919
CID 161404788
CID 161404788
carbonic acid;2-methylpropane
CID 87262286

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yloxysilylpropanoic acid?
The IUPAC name of 2-propan-2-yloxysilylpropanoic acid (CID 175048913) is 2-propan-2-yloxysilylpropanoic acid.
What is the SMILES notation for 2-propan-2-yloxysilylpropanoic acid?
The canonical SMILES for 2-propan-2-yloxysilylpropanoic acid is CC(C)O[SiH2]C(C)C(=O)O.
What is the InChIKey of 2-propan-2-yloxysilylpropanoic acid?
The InChIKey is MQQCMKHMPJWWKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O3Si/c1-4(2)9-10-5(3)6(7)8/h4-5H,10H2,1-3H3,(H,7,8).
What are the key properties of 2-propan-2-yloxysilylpropanoic acid?
2-propan-2-yloxysilylpropanoic acid has a molecular weight of 162.26 g/mol, XLogP of 0.39, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yloxysilylpropanoic acid is sourced from PubChem (CID 175048913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).