(2R)-2-phenyl-2-propan-2-yloxyacetaldehyde

C11H14O2 — CID 124578012

IUPAC(2R)-2-phenyl-2-propan-2-yloxyacetaldehyde
SMILESCC(C)O[C@@H](C=O)c1ccccc1
InChIInChI=1S/C11H14O2/c1-9(2)13-11(8-12)10-6-4-3-5-7-10/h3-9,11H,1-2H3/t11-/m0/s1
InChIKeyCYGCSYIVBPFMHP-NSHDSACASA-N
MW178.23 g/mol
LogP2.35
Rot. Bonds4

About (2R)-2-phenyl-2-propan-2-yloxyacetaldehyde

(2R)-2-phenyl-2-propan-2-yloxyacetaldehyde (PubChem CID 124578012) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is (2R)-2-phenyl-2-propan-2-yloxyacetaldehyde.

Molecular Properties

Compound Name(2R)-2-phenyl-2-propan-2-yloxyacetaldehyde
PubChem CID124578012
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Name(2R)-2-phenyl-2-propan-2-yloxyacetaldehyde
SMILESCC(C)O[C@@H](C=O)c1ccccc1
InChIInChI=1S/C11H14O2/c1-9(2)13-11(8-12)10-6-4-3-5-7-10/h3-9,11H,1-2H3/t11-/m0/s1
InChIKeyCYGCSYIVBPFMHP-NSHDSACASA-N
XLogP2.35
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (2R)-2-phenyl-2-propan-2-yloxyacetaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl (2R)-2-[(1S)-2-oxo-1-phenylethoxy]-2-phenylacetate
CID 11108847
2-methyl-3-phenylbutanal
CID 3024886
2-phenyl-2-phenylmethoxyacetaldehyde
CID 11117750
[(E)-5,5-di(propan-2-yloxy)pent-3-en-2-yl]benzene
CID 21423450
(2-methyl-3-oxo-1-phenylpropyl) acetate
CID 122223707
1,1-dimethoxyethane;2-phenylpropanal
CID 87274023
(2R,3R)-2-fluoro-3-phenylbutanal
CID 134987463
[(1R)-1-phenylethyl] formate
CID 76963066
(2-methyl-3-oxo-1-phenylpropyl) benzoate
CID 122223711
2-(3-methoxy-5-methylphenoxy)-2-phenylacetaldehyde
CID 91405361
methyl (2S)-2-phenyl-2-propan-2-yloxyacetate
CID 102179999
1-[1-[1-(1-phenylprop-2-enoxy)ethylsulfanyl]ethoxy]prop-2-enylbenzene
CID 19001747

Frequently Asked Questions

What is the IUPAC name of (2R)-2-phenyl-2-propan-2-yloxyacetaldehyde?
The IUPAC name of (2R)-2-phenyl-2-propan-2-yloxyacetaldehyde (CID 124578012) is (2R)-2-phenyl-2-propan-2-yloxyacetaldehyde.
What is the SMILES notation for (2R)-2-phenyl-2-propan-2-yloxyacetaldehyde?
The canonical SMILES for (2R)-2-phenyl-2-propan-2-yloxyacetaldehyde is CC(C)O[C@@H](C=O)c1ccccc1.
What is the InChIKey of (2R)-2-phenyl-2-propan-2-yloxyacetaldehyde?
The InChIKey is CYGCSYIVBPFMHP-NSHDSACASA-N. The full InChI is InChI=1S/C11H14O2/c1-9(2)13-11(8-12)10-6-4-3-5-7-10/h3-9,11H,1-2H3/t11-/m0/s1.
What are the key properties of (2R)-2-phenyl-2-propan-2-yloxyacetaldehyde?
(2R)-2-phenyl-2-propan-2-yloxyacetaldehyde has a molecular weight of 178.23 g/mol, XLogP of 2.35, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-phenyl-2-propan-2-yloxyacetaldehyde is sourced from PubChem (CID 124578012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).