1,4-dichloronaphthalen-2-ol

C10H6Cl2O — CID 12578005

IUPAC1,4-dichloronaphthalen-2-ol
SMILESOc1cc(Cl)c2ccccc2c1Cl
InChIInChI=1S/C10H6Cl2O/c11-8-5-9(13)10(12)7-4-2-1-3-6(7)8/h1-5,13H
InChIKeyQAYITGAHWYCLIB-UHFFFAOYSA-N
MW213.06 g/mol
LogP3.85
Rot. Bonds

About 1,4-dichloronaphthalen-2-ol

1,4-dichloronaphthalen-2-ol (PubChem CID 12578005) has the molecular formula C10H6Cl2O and a molecular weight of 213.06 g/mol. Its IUPAC name is 1,4-dichloronaphthalen-2-ol.

Molecular Properties

Compound Name1,4-dichloronaphthalen-2-ol
PubChem CID12578005
Molecular FormulaC10H6Cl2O
Molecular Weight213.06 g/mol
Exact Mass211.98
IUPAC Name1,4-dichloronaphthalen-2-ol
SMILESOc1cc(Cl)c2ccccc2c1Cl
InChIInChI=1S/C10H6Cl2O/c11-8-5-9(13)10(12)7-4-2-1-3-6(7)8/h1-5,13H
InChIKeyQAYITGAHWYCLIB-UHFFFAOYSA-N
XLogP3.85
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.06
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 53440062
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1,6-dichloro-4-sulfanylnaphthalen-2-ol
CID 54067845
1-chloro-4-prop-2-enoxynaphthalen-2-ol
CID 12672908
1-chloronaphthalen-2-ol;naphthalen-2-ol;2,3,4,5-tetrachlorophenol
CID 161098712
2-(4-chloronaphthalen-1-yl)phenol
CID 175271825
2,3,5-trichloro-4-(2,6-dichlorophenyl)phenol
CID 11954040
2,3-dichlorophenol;2,3,4,5-tetrachlorophenol
CID 166770259
phenol;2,3,5-trichlorophenol
CID 172810083
bis(2-chlorophenol);tungsten
CID 88625581
2-chloroanthracene-1,3,9-triol
CID 90968006
5,12-dichlorotetracene
CID 87498157

Frequently Asked Questions

What is the IUPAC name of 1,4-dichloronaphthalen-2-ol?
The IUPAC name of 1,4-dichloronaphthalen-2-ol (CID 12578005) is 1,4-dichloronaphthalen-2-ol.
What is the SMILES notation for 1,4-dichloronaphthalen-2-ol?
The canonical SMILES for 1,4-dichloronaphthalen-2-ol is Oc1cc(Cl)c2ccccc2c1Cl.
What is the InChIKey of 1,4-dichloronaphthalen-2-ol?
The InChIKey is QAYITGAHWYCLIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Cl2O/c11-8-5-9(13)10(12)7-4-2-1-3-6(7)8/h1-5,13H.
What are the key properties of 1,4-dichloronaphthalen-2-ol?
1,4-dichloronaphthalen-2-ol has a molecular weight of 213.06 g/mol, XLogP of 3.85, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dichloronaphthalen-2-ol is sourced from PubChem (CID 12578005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).