diphenylmethanone;ethane

C23H40O — CID 158014879

IUPACdiphenylmethanone;ethane
SMILESCC.CC.CC.CC.CC.O=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C13H10O.5C2H6/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;5*1-2/h1-10H;5*1-2H3
InChIKeyFFIGYZVFJPFQCV-UHFFFAOYSA-N
MW332.57 g/mol
LogP8.05
Rot. Bonds2

About diphenylmethanone;ethane

diphenylmethanone;ethane (PubChem CID 158014879) has the molecular formula C23H40O and a molecular weight of 332.57 g/mol. Its IUPAC name is diphenylmethanone;ethane.

Molecular Properties

Compound Namediphenylmethanone;ethane
PubChem CID158014879
Molecular FormulaC23H40O
Molecular Weight332.57 g/mol
Exact Mass332.31
IUPAC Namediphenylmethanone;ethane
SMILESCC.CC.CC.CC.CC.O=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C13H10O.5C2H6/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;5*1-2/h1-10H;5*1-2H3
InChIKeyFFIGYZVFJPFQCV-UHFFFAOYSA-N
XLogP8.05
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.57
LogP ≤ 58.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

diphenylmethanone
CID 3102
diphenylmethanone;gold
CID 174931146
disodium;diphenylmethanone
CID 19380838
cobalt(2+);diphenylmethanone
CID 19033779
bis(diphenylmethanone);dihydrochloride
CID 69107757
diphenylmethanone;ethane;toluene
CID 157406780
(3-benzoylphenyl)-phenylmethanone;ethane
CID 145125865
(4-benzoylphenyl)-phenylmethanone;ethane;methoxymethane
CID 91498275
acetic acid;diphenylmethanone;hydrate
CID 161284686
2,2-dimethylpropane;diphenylmethanone
CID 159191976
diphenylmethanone;hydron;fluoride
CID 21465824
magnesium;diphenylmethanone;hydride
CID 175114327

Frequently Asked Questions

What is the IUPAC name of diphenylmethanone;ethane?
The IUPAC name of diphenylmethanone;ethane (CID 158014879) is diphenylmethanone;ethane.
What is the SMILES notation for diphenylmethanone;ethane?
The canonical SMILES for diphenylmethanone;ethane is CC.CC.CC.CC.CC.O=C(c1ccccc1)c1ccccc1.
What is the InChIKey of diphenylmethanone;ethane?
The InChIKey is FFIGYZVFJPFQCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10O.5C2H6/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;5*1-2/h1-10H;5*1-2H3.
What are the key properties of diphenylmethanone;ethane?
diphenylmethanone;ethane has a molecular weight of 332.57 g/mol, XLogP of 8.05, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for diphenylmethanone;ethane is sourced from PubChem (CID 158014879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).