7-phenyl-4,10-dioxa-7-bismatricyclo[6.3.0.02,6]undeca-1(11),2,5,8-tetraene

C14H9BiO2 — CID 140603940

IUPAC7-phenyl-4,10-dioxa-7-bismatricyclo[6.3.0.02,6]undeca-1(11),2,5,8-tetraene
SMILESc1ccc([Bi]2c3cocc3-c3cocc32)cc1
InChIInChI=1S/C8H4O2.C6H5.Bi/c1-3-9-5-7(1)8-2-4-10-6-8;1-2-4-6-5-3-1;/h3-6H;1-5H;
InChIKeyNCCAPWHWEOZVCH-UHFFFAOYSA-N
MW418.20 g/mol
LogP1.37
Rot. Bonds1

About 7-phenyl-4,10-dioxa-7-bismatricyclo[6.3.0.02,6]undeca-1(11),2,5,8-tetraene

7-phenyl-4,10-dioxa-7-bismatricyclo[6.3.0.02,6]undeca-1(11),2,5,8-tetraene (PubChem CID 140603940) has the molecular formula C14H9BiO2 and a molecular weight of 418.20 g/mol. Its IUPAC name is 7-phenyl-4,10-dioxa-7-bismatricyclo[6.3.0.02,6]undeca-1(11),2,5,8-tetraene.

Molecular Properties

Compound Name7-phenyl-4,10-dioxa-7-bismatricyclo[6.3.0.02,6]undeca-1(11),2,5,8-tetraene
PubChem CID140603940
Molecular FormulaC14H9BiO2
Molecular Weight418.20 g/mol
Exact Mass418.04
IUPAC Name7-phenyl-4,10-dioxa-7-bismatricyclo[6.3.0.02,6]undeca-1(11),2,5,8-tetraene
SMILESc1ccc([Bi]2c3cocc3-c3cocc32)cc1
InChIInChI=1S/C8H4O2.C6H5.Bi/c1-3-9-5-7(1)8-2-4-10-6-8;1-2-4-6-5-3-1;/h3-6H;1-5H;
InChIKeyNCCAPWHWEOZVCH-UHFFFAOYSA-N
XLogP1.37
TPSA26.28 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.20
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 7-phenyl-4,10-dioxa-7-bismatricyclo[6.3.0.02,6]undeca-1(11),2,5,8-tetraene with MolForge

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Related Compounds

10-phenylbenzo[b][1,4]benzothiabismine
CID 140603927
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13-[4-[4-(4-oxa-13-azatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),2,5,7,9,11,14,16-octaen-13-yl)phenyl]phenyl]-4-oxa-13-azatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),2,5,7,9,11,14,16-octaene
CID 22960204
2,3-diphenyloxadiaziridine
CID 67418852
stibane;triphenylphosphane;hexahydrofluoride
CID 174582566
tetrakis(dioxido(phenyl)borane);octakis(trimethylazanium)
CID 140993389
4,5-dihydrobenzo[e][2]benzofuran-5-ol
CID 13448879
trimethyl-(5,9,10-trimethyl-7-phenyl-3,11-dithia-7-bismatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl)silane
CID 161230223
2-benzofuran;ethenone
CID 175285039
3-methoxy-4-naphthalen-1-ylfuran
CID 90731593
hexakis-phenylantimony(1-)
CID 16708465
Triphenylsilicon
CID 6327682

Frequently Asked Questions

What is the IUPAC name of 7-phenyl-4,10-dioxa-7-bismatricyclo[6.3.0.02,6]undeca-1(11),2,5,8-tetraene?
The IUPAC name of 7-phenyl-4,10-dioxa-7-bismatricyclo[6.3.0.02,6]undeca-1(11),2,5,8-tetraene (CID 140603940) is 7-phenyl-4,10-dioxa-7-bismatricyclo[6.3.0.02,6]undeca-1(11),2,5,8-tetraene.
What is the SMILES notation for 7-phenyl-4,10-dioxa-7-bismatricyclo[6.3.0.02,6]undeca-1(11),2,5,8-tetraene?
The canonical SMILES for 7-phenyl-4,10-dioxa-7-bismatricyclo[6.3.0.02,6]undeca-1(11),2,5,8-tetraene is c1ccc([Bi]2c3cocc3-c3cocc32)cc1.
What is the InChIKey of 7-phenyl-4,10-dioxa-7-bismatricyclo[6.3.0.02,6]undeca-1(11),2,5,8-tetraene?
The InChIKey is NCCAPWHWEOZVCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4O2.C6H5.Bi/c1-3-9-5-7(1)8-2-4-10-6-8;1-2-4-6-5-3-1;/h3-6H;1-5H;.
What are the key properties of 7-phenyl-4,10-dioxa-7-bismatricyclo[6.3.0.02,6]undeca-1(11),2,5,8-tetraene?
7-phenyl-4,10-dioxa-7-bismatricyclo[6.3.0.02,6]undeca-1(11),2,5,8-tetraene has a molecular weight of 418.20 g/mol, XLogP of 1.37, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenyl-4,10-dioxa-7-bismatricyclo[6.3.0.02,6]undeca-1(11),2,5,8-tetraene is sourced from PubChem (CID 140603940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).