dibenzofuran;molecular hydrogen

C12H10O — CID 173065186

IUPACdibenzofuran;molecular hydrogen
SMILES[H][H].c1ccc2c(c1)oc1ccccc12
InChIInChI=1S/C12H8O.H2/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;/h1-8H;1H
InChIKeyCBQVLBFEEPEARL-UHFFFAOYSA-N
MW170.21 g/mol
LogP3.83
Rot. Bonds

About dibenzofuran;molecular hydrogen

dibenzofuran;molecular hydrogen (PubChem CID 173065186) has the molecular formula C12H10O and a molecular weight of 170.21 g/mol. Its IUPAC name is dibenzofuran;molecular hydrogen.

Molecular Properties

Compound Namedibenzofuran;molecular hydrogen
PubChem CID173065186
Molecular FormulaC12H10O
Molecular Weight170.21 g/mol
Exact Mass170.07
IUPAC Namedibenzofuran;molecular hydrogen
SMILES[H][H].c1ccc2c(c1)oc1ccccc12
InChIInChI=1S/C12H8O.H2/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;/h1-8H;1H
InChIKeyCBQVLBFEEPEARL-UHFFFAOYSA-N
XLogP3.83
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

dibenzofuran;hydrofluoride
CID 158307405
dibenzofuran;hydrate
CID 70610865
dibenzofuran;dihydrate;dihydrochloride
CID 21327105
2-deuteriodibenzofuran
CID 90735776
dibenzofuran;ethanol
CID 174821059
10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4,6,8,11,14,16,18-nonaene;ethane
CID 154692122
12,22-dioxahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene
CID 118151066
dibenzofuran-2-amine
CID 19405
2,3-diphenyldibenzofuran
CID 12699263
methylidene(xanthen-9-ylidene)-λ4-sulfane
CID 101030051
dibenzofuran;1,3-oxazole
CID 157355196
CID 153329393
CID 153329393

Frequently Asked Questions

What is the IUPAC name of dibenzofuran;molecular hydrogen?
The IUPAC name of dibenzofuran;molecular hydrogen (CID 173065186) is dibenzofuran;molecular hydrogen.
What is the SMILES notation for dibenzofuran;molecular hydrogen?
The canonical SMILES for dibenzofuran;molecular hydrogen is [H][H].c1ccc2c(c1)oc1ccccc12.
What is the InChIKey of dibenzofuran;molecular hydrogen?
The InChIKey is CBQVLBFEEPEARL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8O.H2/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;/h1-8H;1H.
What are the key properties of dibenzofuran;molecular hydrogen?
dibenzofuran;molecular hydrogen has a molecular weight of 170.21 g/mol, XLogP of 3.83, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dibenzofuran;molecular hydrogen is sourced from PubChem (CID 173065186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).