formaldehyde;bis(2-hydroxy-1,2-diphenylethanone)

C29H26O5 — CID 174440021

IUPACformaldehyde;bis(2-hydroxy-1,2-diphenylethanone)
SMILESC=O.O=C(c1ccccc1)C(O)c1ccccc1.O=C(c1ccccc1)C(O)c1ccccc1
InChIInChI=1S/2C14H12O2.CH2O/c2*15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12;1-2/h2*1-10,13,15H;1H2
InChIKeyLXAXJVBAIZWRLD-UHFFFAOYSA-N
MW454.52 g/mol
LogP5.02
Rot. Bonds6

About formaldehyde;bis(2-hydroxy-1,2-diphenylethanone)

formaldehyde;bis(2-hydroxy-1,2-diphenylethanone) (PubChem CID 174440021) has the molecular formula C29H26O5 and a molecular weight of 454.52 g/mol. Its IUPAC name is formaldehyde;bis(2-hydroxy-1,2-diphenylethanone).

Molecular Properties

Compound Nameformaldehyde;bis(2-hydroxy-1,2-diphenylethanone)
PubChem CID174440021
Molecular FormulaC29H26O5
Molecular Weight454.52 g/mol
Exact Mass454.18
IUPAC Nameformaldehyde;bis(2-hydroxy-1,2-diphenylethanone)
SMILESC=O.O=C(c1ccccc1)C(O)c1ccccc1.O=C(c1ccccc1)C(O)c1ccccc1
InChIInChI=1S/2C14H12O2.CH2O/c2*15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12;1-2/h2*1-10,13,15H;1H2
InChIKeyLXAXJVBAIZWRLD-UHFFFAOYSA-N
XLogP5.02
TPSA91.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500454.52
LogP ≤ 55.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-hydroxy-1,2-diphenylethanone
CID 159399559
deuterium monohydride;2-hydroxy-1,2-diphenylethanone
CID 158356694
2-hydroxy-1,2-diphenylethanone;prop-2-enoic acid
CID 57368066
2-hydroxy-1,2-diphenylethanone;silyloxysilane
CID 173133276
2-hydroxy-1,2-diphenylethanone;propanoic acid
CID 159329247
2-hydroxy-1-phenyl-2-(4-propan-2-ylphenyl)ethanone
CID 23513084
2-hydroxy-1,2-diphenylethanone;1-phenylpropan-1-one
CID 174848942
benzaldehyde;1,2-diphenylethane-1,2-diol;2-hydroxy-1,2-diphenylethanone
CID 87963505
acetaldehyde;2-hydroxy-1,2-diphenylethanone;(2S)-2-hydroxy-1,2-diphenylethanone;(2R)-2-hydroxy-1-phenylpropan-1-one;methane
CID 159381131
ethoxymethanol;2-hydroxy-1,2-diphenylethanone
CID 69429454
2-hydroxy-1,2-diphenylethanone;nonan-5-one
CID 69310835
cyclohexyl(phenyl)methanone;2-hydroxy-1,2-diphenylethanone
CID 175464562

Frequently Asked Questions

What is the IUPAC name of formaldehyde;bis(2-hydroxy-1,2-diphenylethanone)?
The IUPAC name of formaldehyde;bis(2-hydroxy-1,2-diphenylethanone) (CID 174440021) is formaldehyde;bis(2-hydroxy-1,2-diphenylethanone).
What is the SMILES notation for formaldehyde;bis(2-hydroxy-1,2-diphenylethanone)?
The canonical SMILES for formaldehyde;bis(2-hydroxy-1,2-diphenylethanone) is C=O.O=C(c1ccccc1)C(O)c1ccccc1.O=C(c1ccccc1)C(O)c1ccccc1.
What is the InChIKey of formaldehyde;bis(2-hydroxy-1,2-diphenylethanone)?
The InChIKey is LXAXJVBAIZWRLD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C14H12O2.CH2O/c2*15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12;1-2/h2*1-10,13,15H;1H2.
What are the key properties of formaldehyde;bis(2-hydroxy-1,2-diphenylethanone)?
formaldehyde;bis(2-hydroxy-1,2-diphenylethanone) has a molecular weight of 454.52 g/mol, XLogP of 5.02, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for formaldehyde;bis(2-hydroxy-1,2-diphenylethanone) is sourced from PubChem (CID 174440021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).