2,3-dibromo-6-naphthalen-2-ylphenol

C16H10Br2O — CID 175066666

IUPAC2,3-dibromo-6-naphthalen-2-ylphenol
SMILESOc1c(-c2ccc3ccccc3c2)ccc(Br)c1Br
InChIInChI=1S/C16H10Br2O/c17-14-8-7-13(16(19)15(14)18)12-6-5-10-3-1-2-4-11(10)9-12/h1-9,19H
InChIKeyHNLFLDALWMMFEV-UHFFFAOYSA-N
MW378.06 g/mol
LogP5.74
Rot. Bonds1

About 2,3-dibromo-6-naphthalen-2-ylphenol

2,3-dibromo-6-naphthalen-2-ylphenol (PubChem CID 175066666) has the molecular formula C16H10Br2O and a molecular weight of 378.06 g/mol. Its IUPAC name is 2,3-dibromo-6-naphthalen-2-ylphenol.

Molecular Properties

Compound Name2,3-dibromo-6-naphthalen-2-ylphenol
PubChem CID175066666
Molecular FormulaC16H10Br2O
Molecular Weight378.06 g/mol
Exact Mass375.91
IUPAC Name2,3-dibromo-6-naphthalen-2-ylphenol
SMILESOc1c(-c2ccc3ccccc3c2)ccc(Br)c1Br
InChIInChI=1S/C16H10Br2O/c17-14-8-7-13(16(19)15(14)18)12-6-5-10-3-1-2-4-11(10)9-12/h1-9,19H
InChIKeyHNLFLDALWMMFEV-UHFFFAOYSA-N
XLogP5.74
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.06
LogP ≤ 55.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-naphthalen-2-ylbenzene-1,2,3-triol
CID 54019836
2-(2-hydroxy-3-naphthalen-2-ylphenyl)-6-naphthalen-2-ylphenol
CID 24741043
2-naphthalen-2-yl-1-(2-naphthalen-2-ylnaphthalen-1-yl)naphthalene
CID 10744186
2-[2-(4-bromophenyl)phenyl]naphthalene
CID 134433047
1-bromo-6-naphthalen-2-ylpyrene;1,6-dibromopyrene;naphthalen-2-ylboronic acid
CID 161047613
4,6-dibromo-2-naphthalen-2-ylpyrimidine
CID 71324653
2-amino-3-naphthalen-2-ylphenol
CID 175155889
9-(4-naphthalen-2-ylnaphthalen-1-yl)-10-(7-naphthalen-2-ylnaphthalen-2-yl)anthracene
CID 123218552
9-naphthalen-2-yl-10-[4-[4-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphthalen-1-yl]phenyl]anthracene
CID 59523734
2,6-bis(4-naphthalen-2-ylphenyl)-1,5-diphenylnaphthalene;2,6-dibromo-1,5-diphenylnaphthalene;(4-naphthalen-2-ylphenyl)boronic acid
CID 158947879
9-bromo-10-[2-(6-deuterionaphthalen-2-yl)phenyl]anthracene
CID 171449361
2-(5-naphthalen-2-yl-1H-pyrrol-2-yl)naphthalen-1-ol
CID 19431267

Frequently Asked Questions

What is the IUPAC name of 2,3-dibromo-6-naphthalen-2-ylphenol?
The IUPAC name of 2,3-dibromo-6-naphthalen-2-ylphenol (CID 175066666) is 2,3-dibromo-6-naphthalen-2-ylphenol.
What is the SMILES notation for 2,3-dibromo-6-naphthalen-2-ylphenol?
The canonical SMILES for 2,3-dibromo-6-naphthalen-2-ylphenol is Oc1c(-c2ccc3ccccc3c2)ccc(Br)c1Br.
What is the InChIKey of 2,3-dibromo-6-naphthalen-2-ylphenol?
The InChIKey is HNLFLDALWMMFEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10Br2O/c17-14-8-7-13(16(19)15(14)18)12-6-5-10-3-1-2-4-11(10)9-12/h1-9,19H.
What are the key properties of 2,3-dibromo-6-naphthalen-2-ylphenol?
2,3-dibromo-6-naphthalen-2-ylphenol has a molecular weight of 378.06 g/mol, XLogP of 5.74, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dibromo-6-naphthalen-2-ylphenol is sourced from PubChem (CID 175066666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).