[4-(1,3-dioxolan-2-yl)phenyl]-phenylmethanone

C16H14O3 — CID 24726701

IUPAC[4-(1,3-dioxolan-2-yl)phenyl]-phenylmethanone
SMILESO=C(c1ccccc1)c1ccc(C2OCCO2)cc1
InChIInChI=1S/C16H14O3/c17-15(12-4-2-1-3-5-12)13-6-8-14(9-7-13)16-18-10-11-19-16/h1-9,16H,10-11H2
InChIKeyQHYFENSENCKTMG-UHFFFAOYSA-N
MW254.29 g/mol
LogP2.96
Rot. Bonds3

About [4-(1,3-dioxolan-2-yl)phenyl]-phenylmethanone

[4-(1,3-dioxolan-2-yl)phenyl]-phenylmethanone (PubChem CID 24726701) has the molecular formula C16H14O3 and a molecular weight of 254.29 g/mol. Its IUPAC name is [4-(1,3-dioxolan-2-yl)phenyl]-phenylmethanone.

Molecular Properties

Compound Name[4-(1,3-dioxolan-2-yl)phenyl]-phenylmethanone
PubChem CID24726701
Molecular FormulaC16H14O3
Molecular Weight254.29 g/mol
Exact Mass254.09
IUPAC Name[4-(1,3-dioxolan-2-yl)phenyl]-phenylmethanone
SMILESO=C(c1ccccc1)c1ccc(C2OCCO2)cc1
InChIInChI=1S/C16H14O3/c17-15(12-4-2-1-3-5-12)13-6-8-14(9-7-13)16-18-10-11-19-16/h1-9,16H,10-11H2
InChIKeyQHYFENSENCKTMG-UHFFFAOYSA-N
XLogP2.96
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3-chlorophenyl)-[4-(1,3-dioxolan-2-yl)phenyl]methanone
CID 24726718
(3-bromophenyl)-[4-(1,3-dioxolan-2-yl)phenyl]methanone
CID 24726716
1-[4-(1,3-dioxolan-2-yl)phenyl]-2-phenylprop-2-en-1-one
CID 143124468
[4-(1,3-dioxolan-2-yl)phenyl]-(4-methylsulfanylphenyl)methanone
CID 24726715
[4-[3-(1,3-dioxolan-2-yl)anilino]phenyl]-phenylmethanone
CID 11348524
[3-[[4-(1,3-dioxolan-2-yl)phenyl]methoxy]phenyl]-phenylmethanone
CID 71113242
(3-chloro-5-fluorophenyl)-[4-(1,3-dioxolan-2-yl)phenyl]methanone
CID 24726737
diphenylmethanone
CID 3102
cyclopentyl-[4-(1,3-dioxolan-2-yl)phenyl]methanone
CID 24726750
2-phenyl-1,3-dioxonane
CID 70602118
2-(4-diphenylphosphorylphenyl)-1,3-dioxolane
CID 169083681
diphenylmethanone;gold
CID 174931146

Frequently Asked Questions

What is the IUPAC name of [4-(1,3-dioxolan-2-yl)phenyl]-phenylmethanone?
The IUPAC name of [4-(1,3-dioxolan-2-yl)phenyl]-phenylmethanone (CID 24726701) is [4-(1,3-dioxolan-2-yl)phenyl]-phenylmethanone.
What is the SMILES notation for [4-(1,3-dioxolan-2-yl)phenyl]-phenylmethanone?
The canonical SMILES for [4-(1,3-dioxolan-2-yl)phenyl]-phenylmethanone is O=C(c1ccccc1)c1ccc(C2OCCO2)cc1.
What is the InChIKey of [4-(1,3-dioxolan-2-yl)phenyl]-phenylmethanone?
The InChIKey is QHYFENSENCKTMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14O3/c17-15(12-4-2-1-3-5-12)13-6-8-14(9-7-13)16-18-10-11-19-16/h1-9,16H,10-11H2.
What are the key properties of [4-(1,3-dioxolan-2-yl)phenyl]-phenylmethanone?
[4-(1,3-dioxolan-2-yl)phenyl]-phenylmethanone has a molecular weight of 254.29 g/mol, XLogP of 2.96, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1,3-dioxolan-2-yl)phenyl]-phenylmethanone is sourced from PubChem (CID 24726701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).