dibenzo-p-dioxin-2-yl(phenyl)methanone

C19H12O3 — CID 4613440

IUPACdibenzo-p-dioxin-2-yl(phenyl)methanone
SMILESO=C(c1ccccc1)c1ccc2c(c1)Oc1ccccc1O2
InChIInChI=1S/C19H12O3/c20-19(13-6-2-1-3-7-13)14-10-11-17-18(12-14)22-16-9-5-4-8-15(16)21-17/h1-12H
InChIKeyBSXRIMNERWPXTA-UHFFFAOYSA-N
MW288.30 g/mol
LogP4.82
Rot. Bonds2

About dibenzo-p-dioxin-2-yl(phenyl)methanone

dibenzo-p-dioxin-2-yl(phenyl)methanone (PubChem CID 4613440) has the molecular formula C19H12O3 and a molecular weight of 288.30 g/mol. Its IUPAC name is dibenzo-p-dioxin-2-yl(phenyl)methanone.

Molecular Properties

Compound Namedibenzo-p-dioxin-2-yl(phenyl)methanone
PubChem CID4613440
Molecular FormulaC19H12O3
Molecular Weight288.30 g/mol
Exact Mass288.08
IUPAC Namedibenzo-p-dioxin-2-yl(phenyl)methanone
SMILESO=C(c1ccccc1)c1ccc2c(c1)Oc1ccccc1O2
InChIInChI=1S/C19H12O3/c20-19(13-6-2-1-3-7-13)14-10-11-17-18(12-14)22-16-9-5-4-8-15(16)21-17/h1-12H
InChIKeyBSXRIMNERWPXTA-UHFFFAOYSA-N
XLogP4.82
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.30
LogP ≤ 54.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

diphenylmethanone
CID 3102
diphenylmethanone;gold
CID 174931146
cobalt(2+);diphenylmethanone
CID 19033779
disodium;diphenylmethanone
CID 19380838
bis(diphenylmethanone);dihydrochloride
CID 69107757
N-tert-butyldibenzo-p-dioxin-2-carboxamide
CID 101091917
(3-benzoylphenyl)-phenylmethanone;ethane
CID 145125865
[3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone
CID 19009361
naphthalen-2-yl(phenyl)(113C)methanone
CID 101359138
[24-(2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(26),9(14),10,12,22,24-hexaene-11-carbonyl)-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaen-11-yl]-(2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(26),9(14),10,12,22,24-hexaen-11-yl)methanone
CID 3265829
diphenylmethanone;ethane
CID 158014879
diphenylmethanone;hydron;fluoride
CID 21465824

Frequently Asked Questions

What is the IUPAC name of dibenzo-p-dioxin-2-yl(phenyl)methanone?
The IUPAC name of dibenzo-p-dioxin-2-yl(phenyl)methanone (CID 4613440) is dibenzo-p-dioxin-2-yl(phenyl)methanone.
What is the SMILES notation for dibenzo-p-dioxin-2-yl(phenyl)methanone?
The canonical SMILES for dibenzo-p-dioxin-2-yl(phenyl)methanone is O=C(c1ccccc1)c1ccc2c(c1)Oc1ccccc1O2.
What is the InChIKey of dibenzo-p-dioxin-2-yl(phenyl)methanone?
The InChIKey is BSXRIMNERWPXTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12O3/c20-19(13-6-2-1-3-7-13)14-10-11-17-18(12-14)22-16-9-5-4-8-15(16)21-17/h1-12H.
What are the key properties of dibenzo-p-dioxin-2-yl(phenyl)methanone?
dibenzo-p-dioxin-2-yl(phenyl)methanone has a molecular weight of 288.30 g/mol, XLogP of 4.82, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dibenzo-p-dioxin-2-yl(phenyl)methanone is sourced from PubChem (CID 4613440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).