ethoxymethanol;2-hydroxy-1,2-diphenylethanone

C17H20O4 — CID 69429454

IUPACethoxymethanol;2-hydroxy-1,2-diphenylethanone
SMILESCCOCO.O=C(c1ccccc1)C(O)c1ccccc1
InChIInChI=1S/C14H12O2.C3H8O2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12;1-2-5-3-4/h1-10,13,15H;4H,2-3H2,1H3
InChIKeyJKDCDHAUBLMXHW-UHFFFAOYSA-N
MW288.34 g/mol
LogP2.58
Rot. Bonds5

About ethoxymethanol;2-hydroxy-1,2-diphenylethanone

ethoxymethanol;2-hydroxy-1,2-diphenylethanone (PubChem CID 69429454) has the molecular formula C17H20O4 and a molecular weight of 288.34 g/mol. Its IUPAC name is ethoxymethanol;2-hydroxy-1,2-diphenylethanone.

Molecular Properties

Compound Nameethoxymethanol;2-hydroxy-1,2-diphenylethanone
PubChem CID69429454
Molecular FormulaC17H20O4
Molecular Weight288.34 g/mol
Exact Mass288.14
IUPAC Nameethoxymethanol;2-hydroxy-1,2-diphenylethanone
SMILESCCOCO.O=C(c1ccccc1)C(O)c1ccccc1
InChIInChI=1S/C14H12O2.C3H8O2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12;1-2-5-3-4/h1-10,13,15H;4H,2-3H2,1H3
InChIKeyJKDCDHAUBLMXHW-UHFFFAOYSA-N
XLogP2.58
TPSA66.76 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.34
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-hydroxy-1,2-diphenylethanone;propanoic acid
CID 159329247
ethoxyethane;fluoren-9-one;tris(2-hydroxy-1,2-diphenylethanone);methoxymethane
CID 174800986
2-hydroxy-1,2-diphenylethanone
CID 159399559
2-hydroxy-1,2-diphenylethanone;1-phenylpropan-1-one
CID 174848942
2-hydroxy-1,2-diphenylethanone;silyloxysilane
CID 173133276
deuterium monohydride;2-hydroxy-1,2-diphenylethanone
CID 158356694
formaldehyde;bis(2-hydroxy-1,2-diphenylethanone)
CID 174440021
diethoxyphosphinothioyloxy-diethoxy-sulfanylidene-λ5-phosphane;2-hydroxy-1,2-diphenylethanone
CID 88633467
2-hydroxy-1,2-diphenylethanone;nonan-5-one
CID 69310835
2-hydroxy-1-phenyl-2-(4-propan-2-ylphenyl)ethanone
CID 23513084
hexyl carbamate;2-hydroxy-1,2-diphenylethanone
CID 138541446
2-hydroxy-1,2-diphenylethanone;2-hydroxy-2-phenyl-1-(2-propylphenyl)ethanone
CID 159551981

Frequently Asked Questions

What is the IUPAC name of ethoxymethanol;2-hydroxy-1,2-diphenylethanone?
The IUPAC name of ethoxymethanol;2-hydroxy-1,2-diphenylethanone (CID 69429454) is ethoxymethanol;2-hydroxy-1,2-diphenylethanone.
What is the SMILES notation for ethoxymethanol;2-hydroxy-1,2-diphenylethanone?
The canonical SMILES for ethoxymethanol;2-hydroxy-1,2-diphenylethanone is CCOCO.O=C(c1ccccc1)C(O)c1ccccc1.
What is the InChIKey of ethoxymethanol;2-hydroxy-1,2-diphenylethanone?
The InChIKey is JKDCDHAUBLMXHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12O2.C3H8O2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12;1-2-5-3-4/h1-10,13,15H;4H,2-3H2,1H3.
What are the key properties of ethoxymethanol;2-hydroxy-1,2-diphenylethanone?
ethoxymethanol;2-hydroxy-1,2-diphenylethanone has a molecular weight of 288.34 g/mol, XLogP of 2.58, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxymethanol;2-hydroxy-1,2-diphenylethanone is sourced from PubChem (CID 69429454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).