1-bromo-2-(2-bromophenoxy)benzene

C12H8Br2O — CID 3465096

IUPAC1-bromo-2-(2-bromophenoxy)benzene
SMILESBrc1ccccc1Oc1ccccc1Br
InChIInChI=1S/C12H8Br2O/c13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)14/h1-8H
InChIKeyJMSKYMHFNWGUJG-UHFFFAOYSA-N
MW328.00 g/mol
LogP5.00
Rot. Bonds2

About 1-bromo-2-(2-bromophenoxy)benzene

1-bromo-2-(2-bromophenoxy)benzene (PubChem CID 3465096) has the molecular formula C12H8Br2O and a molecular weight of 328.00 g/mol. Its IUPAC name is 1-bromo-2-(2-bromophenoxy)benzene.

Molecular Properties

Compound Name1-bromo-2-(2-bromophenoxy)benzene
PubChem CID3465096
Molecular FormulaC12H8Br2O
Molecular Weight328.00 g/mol
Exact Mass325.89
IUPAC Name1-bromo-2-(2-bromophenoxy)benzene
SMILESBrc1ccccc1Oc1ccccc1Br
InChIInChI=1S/C12H8Br2O/c13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)14/h1-8H
InChIKeyJMSKYMHFNWGUJG-UHFFFAOYSA-N
XLogP5.00
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.00
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-bromo-6-(2-bromophenoxy)benzonitrile
CID 114881565
1-bromo-2-(4-fluorophenoxy)benzene
CID 18423530
1-bromo-2-(2-bromophenoxy)benzene;dicyclohexylphosphane
CID 155269265
2,6-bis(2-bromophenoxy)pyrazine
CID 177456586
tris(2-bromophenyl) phosphite
CID 54277872
1-bromo-2-methoxybenzene;ethane
CID 91096433
1-[2-(2-bromophenoxy)phenyl]-N-methylethanamine
CID 43284837
[2-(2-bromophenoxy)-6-fluorophenyl]methanamine
CID 79517645
[2-(2-bromophenoxy)phenyl]-phenylmethanone
CID 70097851
2-(2-bromophenoxy)-4-chloroaniline
CID 115469253
5-bromo-2-(2-bromophenoxy)-4-fluoroaniline
CID 66112531
2-[2-(2-bromophenoxy)phenyl]ethynyl-trimethylsilane
CID 164681631

Frequently Asked Questions

What is the IUPAC name of 1-bromo-2-(2-bromophenoxy)benzene?
The IUPAC name of 1-bromo-2-(2-bromophenoxy)benzene (CID 3465096) is 1-bromo-2-(2-bromophenoxy)benzene.
What is the SMILES notation for 1-bromo-2-(2-bromophenoxy)benzene?
The canonical SMILES for 1-bromo-2-(2-bromophenoxy)benzene is Brc1ccccc1Oc1ccccc1Br.
What is the InChIKey of 1-bromo-2-(2-bromophenoxy)benzene?
The InChIKey is JMSKYMHFNWGUJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8Br2O/c13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)14/h1-8H.
What are the key properties of 1-bromo-2-(2-bromophenoxy)benzene?
1-bromo-2-(2-bromophenoxy)benzene has a molecular weight of 328.00 g/mol, XLogP of 5.00, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-2-(2-bromophenoxy)benzene is sourced from PubChem (CID 3465096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).