6-bromo-2-phenyl-2H-chromene

C15H11BrO — CID 44721340

IUPAC6-bromo-2-phenyl-2H-chromene
SMILESBrc1ccc2c(c1)C=CC(c1ccccc1)O2
InChIInChI=1S/C15H11BrO/c16-13-7-9-15-12(10-13)6-8-14(17-15)11-4-2-1-3-5-11/h1-10,14H
InChIKeyJJZHGOBPUUAZTB-UHFFFAOYSA-N
MW287.16 g/mol
LogP4.60
Rot. Bonds1

About 6-bromo-2-phenyl-2H-chromene

6-bromo-2-phenyl-2H-chromene (PubChem CID 44721340) has the molecular formula C15H11BrO and a molecular weight of 287.16 g/mol. Its IUPAC name is 6-bromo-2-phenyl-2H-chromene.

Molecular Properties

Compound Name6-bromo-2-phenyl-2H-chromene
PubChem CID44721340
Molecular FormulaC15H11BrO
Molecular Weight287.16 g/mol
Exact Mass286.00
IUPAC Name6-bromo-2-phenyl-2H-chromene
SMILESBrc1ccc2c(c1)C=CC(c1ccccc1)O2
InChIInChI=1S/C15H11BrO/c16-13-7-9-15-12(10-13)6-8-14(17-15)11-4-2-1-3-5-11/h1-10,14H
InChIKeyJJZHGOBPUUAZTB-UHFFFAOYSA-N
XLogP4.60
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.16
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-phenyl-2H-chromene?
The IUPAC name of 6-bromo-2-phenyl-2H-chromene (CID 44721340) is 6-bromo-2-phenyl-2H-chromene.
What is the SMILES notation for 6-bromo-2-phenyl-2H-chromene?
The canonical SMILES for 6-bromo-2-phenyl-2H-chromene is Brc1ccc2c(c1)C=CC(c1ccccc1)O2.
What is the InChIKey of 6-bromo-2-phenyl-2H-chromene?
The InChIKey is JJZHGOBPUUAZTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11BrO/c16-13-7-9-15-12(10-13)6-8-14(17-15)11-4-2-1-3-5-11/h1-10,14H.
What are the key properties of 6-bromo-2-phenyl-2H-chromene?
6-bromo-2-phenyl-2H-chromene has a molecular weight of 287.16 g/mol, XLogP of 4.60, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-phenyl-2H-chromene is sourced from PubChem (CID 44721340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).