1-bromo-2-phenylnaphthalene

C16H11Br — CID 10956972

IUPAC1-bromo-2-phenylnaphthalene
SMILESBrc1c(-c2ccccc2)ccc2ccccc12
InChIInChI=1S/C16H11Br/c17-16-14-9-5-4-8-13(14)10-11-15(16)12-6-2-1-3-7-12/h1-11H
InChIKeyANKXTSUKPPHQJR-UHFFFAOYSA-N
MW283.17 g/mol
LogP5.27
Rot. Bonds1

About 1-bromo-2-phenylnaphthalene

1-bromo-2-phenylnaphthalene (PubChem CID 10956972) has the molecular formula C16H11Br and a molecular weight of 283.17 g/mol. Its IUPAC name is 1-bromo-2-phenylnaphthalene.

Molecular Properties

Compound Name1-bromo-2-phenylnaphthalene
PubChem CID10956972
Molecular FormulaC16H11Br
Molecular Weight283.17 g/mol
Exact Mass282.00
IUPAC Name1-bromo-2-phenylnaphthalene
SMILESBrc1c(-c2ccccc2)ccc2ccccc12
InChIInChI=1S/C16H11Br/c17-16-14-9-5-4-8-13(14)10-11-15(16)12-6-2-1-3-7-12/h1-11H
InChIKeyANKXTSUKPPHQJR-UHFFFAOYSA-N
XLogP5.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.17
LogP ≤ 55.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-[3,5-bis(1-bromonaphthalen-2-yl)phenyl]-1-bromonaphthalene
CID 71484457
3-(1-bromonaphthalen-2-yl)thiophene
CID 68643635
1,2-diphenylnaphthalene
CID 11208267
2-phenyl-1-(2-phenylnaphthalen-1-yl)sulfanylnaphthalene
CID 68507510
1-(2-methylphenyl)-2-phenylnaphthalene
CID 101418577
1,1'-biphenyl;naphthalene;phenanthrene
CID 157410235
2-(1-bromonaphthalen-2-yl)-4-(4-dibenzofuran-1-ylphenyl)-6-phenyl-1,3,5-triazine
CID 156551761
3-(1-bromonaphthalen-2-yl)naphthalen-2-ol;ethane
CID 145193800
2-(2-phenylphenyl)naphthalen-1-amine
CID 141161672
2-bromo-3-iodo-1,4-diphenylbenzene
CID 167285519
2-phenyl-1-(2-phenylphenanthren-1-yl)sulfanylphenanthrene
CID 152627855
1-(2-methylnaphthalen-1-yl)-2-phenylnaphthalene
CID 11739441

Frequently Asked Questions

What is the IUPAC name of 1-bromo-2-phenylnaphthalene?
The IUPAC name of 1-bromo-2-phenylnaphthalene (CID 10956972) is 1-bromo-2-phenylnaphthalene.
What is the SMILES notation for 1-bromo-2-phenylnaphthalene?
The canonical SMILES for 1-bromo-2-phenylnaphthalene is Brc1c(-c2ccccc2)ccc2ccccc12.
What is the InChIKey of 1-bromo-2-phenylnaphthalene?
The InChIKey is ANKXTSUKPPHQJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11Br/c17-16-14-9-5-4-8-13(14)10-11-15(16)12-6-2-1-3-7-12/h1-11H.
What are the key properties of 1-bromo-2-phenylnaphthalene?
1-bromo-2-phenylnaphthalene has a molecular weight of 283.17 g/mol, XLogP of 5.27, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-2-phenylnaphthalene is sourced from PubChem (CID 10956972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).