2-(4-bromophenyl)-4H-chromene

C15H11BrO — CID 135086325

IUPAC2-(4-bromophenyl)-4H-chromene
SMILESBrc1ccc(C2=CCc3ccccc3O2)cc1
InChIInChI=1S/C15H11BrO/c16-13-8-5-12(6-9-13)15-10-7-11-3-1-2-4-14(11)17-15/h1-6,8-10H,7H2
InChIKeySKQYBNBJWXXFMX-UHFFFAOYSA-N
MW287.16 g/mol
LogP4.43
Rot. Bonds1

About 2-(4-bromophenyl)-4H-chromene

2-(4-bromophenyl)-4H-chromene (PubChem CID 135086325) has the molecular formula C15H11BrO and a molecular weight of 287.16 g/mol. Its IUPAC name is 2-(4-bromophenyl)-4H-chromene.

Molecular Properties

Compound Name2-(4-bromophenyl)-4H-chromene
PubChem CID135086325
Molecular FormulaC15H11BrO
Molecular Weight287.16 g/mol
Exact Mass286.00
IUPAC Name2-(4-bromophenyl)-4H-chromene
SMILESBrc1ccc(C2=CCc3ccccc3O2)cc1
InChIInChI=1S/C15H11BrO/c16-13-8-5-12(6-9-13)15-10-7-11-3-1-2-4-14(11)17-15/h1-6,8-10H,7H2
InChIKeySKQYBNBJWXXFMX-UHFFFAOYSA-N
XLogP4.43
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 ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-(4H-chromen-2-yl)-1,2-thiazole
CID 91234249
2-fluoro-4H-chromene
CID 54487048
2-naphthalen-1-yl-4H-chromene
CID 102038001
7-bromo-2-[3-(3-methylphenyl)phenyl]-4H-chromene
CID 138570323
2-chloro-4H-chromene
CID 66790877
2-(4-bromophenyl)dibenzo-p-dioxin
CID 126629841
2-bromo-1-(4H-chromen-2-yl)ethanone
CID 91619660
2-(4H-benzo[g]chromen-2-yl)-4H-benzo[g]chromene
CID 69266903
2-isocyanato-4H-chromene
CID 23371908
9H-xanthene
CID 7107
2,3-dibromo-4H-chromene
CID 18172585
2-(4-bromophenyl)-3,5-dihydrochromeno[2,3-d]pyrimidin-4-one
CID 22515948

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-4H-chromene?
The IUPAC name of 2-(4-bromophenyl)-4H-chromene (CID 135086325) is 2-(4-bromophenyl)-4H-chromene.
What is the SMILES notation for 2-(4-bromophenyl)-4H-chromene?
The canonical SMILES for 2-(4-bromophenyl)-4H-chromene is Brc1ccc(C2=CCc3ccccc3O2)cc1.
What is the InChIKey of 2-(4-bromophenyl)-4H-chromene?
The InChIKey is SKQYBNBJWXXFMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11BrO/c16-13-8-5-12(6-9-13)15-10-7-11-3-1-2-4-14(11)17-15/h1-6,8-10H,7H2.
What are the key properties of 2-(4-bromophenyl)-4H-chromene?
2-(4-bromophenyl)-4H-chromene has a molecular weight of 287.16 g/mol, XLogP of 4.43, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-4H-chromene is sourced from PubChem (CID 135086325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).