6-bromo-1,2-dihydrodibenzofuran

C12H9BrO — CID 121420689

IUPAC6-bromo-1,2-dihydrodibenzofuran
SMILESBrc1cccc2c3c(oc12)C=CCC3
InChIInChI=1S/C12H9BrO/c13-10-6-3-5-9-8-4-1-2-7-11(8)14-12(9)10/h2-3,5-7H,1,4H2
InChIKeyVDTCFPZRERMUKD-UHFFFAOYSA-N
MW249.11 g/mol
LogP4.15
Rot. Bonds

About 6-bromo-1,2-dihydrodibenzofuran

6-bromo-1,2-dihydrodibenzofuran (PubChem CID 121420689) has the molecular formula C12H9BrO and a molecular weight of 249.11 g/mol. Its IUPAC name is 6-bromo-1,2-dihydrodibenzofuran.

Molecular Properties

Compound Name6-bromo-1,2-dihydrodibenzofuran
PubChem CID121420689
Molecular FormulaC12H9BrO
Molecular Weight249.11 g/mol
Exact Mass247.98
IUPAC Name6-bromo-1,2-dihydrodibenzofuran
SMILESBrc1cccc2c3c(oc12)C=CCC3
InChIInChI=1S/C12H9BrO/c13-10-6-3-5-9-8-4-1-2-7-11(8)14-12(9)10/h2-3,5-7H,1,4H2
InChIKeyVDTCFPZRERMUKD-UHFFFAOYSA-N
XLogP4.15
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.11
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

8,9-dihydrodibenzofuran-4-ylboronic acid
CID 123567559
6-(10-phenylanthracen-9-yl)-1,2-dihydrodibenzofuran
CID 87631578
ethane;N-phenyl-8,9-dihydrodibenzofuran-4-amine
CID 145105452
6-(10-pyren-1-ylanthracen-9-yl)-1,2-dihydrodibenzofuran
CID 88564296
9-[10-(8,9-dihydrodibenzofuran-4-yl)phenanthren-9-yl]fluoren-9-ol
CID 163459929
4-amino-8,9-dihydrodibenzofuran-3-carbonitrile
CID 163438436
2-bromo-4-(8,9-dihydrodibenzofuran-3-yl)dibenzofuran
CID 170051931
2-bromo-9,10-dihydro-8H-cyclohepta[b][1]benzofuran
CID 134504475
4-[4-[8-[4-(8,9-dihydrodibenzofuran-4-yl)phenyl]pyren-1-yl]phenyl]dibenzofuran
CID 88912607
2-[3-(8,9-dihydrodibenzofuran-4-yl)phenyl]-3-(2,4,6-trimethylphenyl)phenanthro[9,10-b]pyrazine
CID 88905815
4-(4,30-dioxa-1-azanonacyclo[17.13.1.02,14.03,11.05,10.015,33.020,32.023,31.024,29]tritriaconta-2(14),3(11),5,7,9,12,15(33),16,18,20(32),21,23(31),24(29),27-tetradecaen-17-yl)benzonitrile
CID 155201339
2-chloro-4-[3-(7,8-dihydronaphtho[1,2-b][1]benzofuran-5-yl)phenyl]-6-phenyl-1,3,5-triazine
CID 174310954

Frequently Asked Questions

What is the IUPAC name of 6-bromo-1,2-dihydrodibenzofuran?
The IUPAC name of 6-bromo-1,2-dihydrodibenzofuran (CID 121420689) is 6-bromo-1,2-dihydrodibenzofuran.
What is the SMILES notation for 6-bromo-1,2-dihydrodibenzofuran?
The canonical SMILES for 6-bromo-1,2-dihydrodibenzofuran is Brc1cccc2c3c(oc12)C=CCC3.
What is the InChIKey of 6-bromo-1,2-dihydrodibenzofuran?
The InChIKey is VDTCFPZRERMUKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9BrO/c13-10-6-3-5-9-8-4-1-2-7-11(8)14-12(9)10/h2-3,5-7H,1,4H2.
What are the key properties of 6-bromo-1,2-dihydrodibenzofuran?
6-bromo-1,2-dihydrodibenzofuran has a molecular weight of 249.11 g/mol, XLogP of 4.15, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-1,2-dihydrodibenzofuran is sourced from PubChem (CID 121420689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).