8-bromo-[1]benzofuro[3,2-c]chromen-6-one

C15H7BrO3 — CID 132544838

IUPAC8-bromo-[1]benzofuro[3,2-c]chromen-6-one
SMILESO=c1oc2ccccc2c2oc3ccc(Br)cc3c12
InChIInChI=1S/C15H7BrO3/c16-8-5-6-12-10(7-8)13-14(18-12)9-3-1-2-4-11(9)19-15(13)17/h1-7H
InChIKeyIGIWFQWBNAWGPB-UHFFFAOYSA-N
MW315.12 g/mol
LogP4.45
Rot. Bonds

About 8-bromo-[1]benzofuro[3,2-c]chromen-6-one

8-bromo-[1]benzofuro[3,2-c]chromen-6-one (PubChem CID 132544838) has the molecular formula C15H7BrO3 and a molecular weight of 315.12 g/mol. Its IUPAC name is 8-bromo-[1]benzofuro[3,2-c]chromen-6-one.

Molecular Properties

Compound Name8-bromo-[1]benzofuro[3,2-c]chromen-6-one
PubChem CID132544838
Molecular FormulaC15H7BrO3
Molecular Weight315.12 g/mol
Exact Mass313.96
IUPAC Name8-bromo-[1]benzofuro[3,2-c]chromen-6-one
SMILESO=c1oc2ccccc2c2oc3ccc(Br)cc3c12
InChIInChI=1S/C15H7BrO3/c16-8-5-6-12-10(7-8)13-14(18-12)9-3-1-2-4-11(9)19-15(13)17/h1-7H
InChIKeyIGIWFQWBNAWGPB-UHFFFAOYSA-N
XLogP4.45
TPSA43.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.12
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cumarine', 'substructure': 'N/A'}

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Related Compounds

7-bromo-[1]benzofuro[3,2-b]chromen-11-one
CID 153449994
2,3-dimethyl-[1]benzofuro[3,2-c]chromen-6-one
CID 102369758
2-methoxy-[1]benzofuro[3,2-c]chromen-6-one
CID 110272886
3,4-dimethylpyrano[3,2-c]chromene-2,5-dione
CID 23605341
8-bromo-3-methyl-2-phenylchromeno[4,3-c]pyrazol-4-one
CID 14873174
N-[2-(4-bromophenyl)-4-oxofuro[3,2-c]chromen-3-yl]benzamide
CID 135024757
dibenzofuran;2,8-dibromodibenzofuran;dichloromethane;molecular bromine
CID 159889298
6-bromo-4-phenyl-3-phenylselanylchromen-2-one
CID 164684629
8-hydroxy-9-(piperidin-1-ylmethyl)-[1]benzofuro[3,2-c]chromen-6-one
CID 155511467
3-(3-bromophenyl)-4-methylchromen-2-one
CID 688765
7-bromo-[1]benzothiolo[3,2-b]chromen-11-one
CID 153449997
3-bromophenanthro[1,2-b][1]benzofuran
CID 132507376

Frequently Asked Questions

What is the IUPAC name of 8-bromo-[1]benzofuro[3,2-c]chromen-6-one?
The IUPAC name of 8-bromo-[1]benzofuro[3,2-c]chromen-6-one (CID 132544838) is 8-bromo-[1]benzofuro[3,2-c]chromen-6-one.
What is the SMILES notation for 8-bromo-[1]benzofuro[3,2-c]chromen-6-one?
The canonical SMILES for 8-bromo-[1]benzofuro[3,2-c]chromen-6-one is O=c1oc2ccccc2c2oc3ccc(Br)cc3c12.
What is the InChIKey of 8-bromo-[1]benzofuro[3,2-c]chromen-6-one?
The InChIKey is IGIWFQWBNAWGPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H7BrO3/c16-8-5-6-12-10(7-8)13-14(18-12)9-3-1-2-4-11(9)19-15(13)17/h1-7H.
What are the key properties of 8-bromo-[1]benzofuro[3,2-c]chromen-6-one?
8-bromo-[1]benzofuro[3,2-c]chromen-6-one has a molecular weight of 315.12 g/mol, XLogP of 4.45, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-[1]benzofuro[3,2-c]chromen-6-one is sourced from PubChem (CID 132544838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).