5-chloro-7,8-dimethoxynaphthalen-1-ol

C12H11ClO3 — CID 86132607

IUPAC5-chloro-7,8-dimethoxynaphthalen-1-ol
SMILESCOc1cc(Cl)c2cccc(O)c2c1OC
InChIInChI=1S/C12H11ClO3/c1-15-10-6-8(13)7-4-3-5-9(14)11(7)12(10)16-2/h3-6,14H,1-2H3
InChIKeyRXQFAJOMCFNMMF-UHFFFAOYSA-N
MW238.67 g/mol
LogP3.22
Rot. Bonds2

About 5-chloro-7,8-dimethoxynaphthalen-1-ol

5-chloro-7,8-dimethoxynaphthalen-1-ol (PubChem CID 86132607) has the molecular formula C12H11ClO3 and a molecular weight of 238.67 g/mol. Its IUPAC name is 5-chloro-7,8-dimethoxynaphthalen-1-ol.

Molecular Properties

Compound Name5-chloro-7,8-dimethoxynaphthalen-1-ol
PubChem CID86132607
Molecular FormulaC12H11ClO3
Molecular Weight238.67 g/mol
Exact Mass238.04
IUPAC Name5-chloro-7,8-dimethoxynaphthalen-1-ol
SMILESCOc1cc(Cl)c2cccc(O)c2c1OC
InChIInChI=1S/C12H11ClO3/c1-15-10-6-8(13)7-4-3-5-9(14)11(7)12(10)16-2/h3-6,14H,1-2H3
InChIKeyRXQFAJOMCFNMMF-UHFFFAOYSA-N
XLogP3.22
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.67
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-chloro-7,8-dimethoxynaphthalen-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6,7,8-trimethoxynaphthalen-1-ol
CID 15073678
6-chloro-2,3,4-trimethoxyphenol
CID 13442752
6-bromo-5,8-dimethoxynaphthalen-1-ol
CID 15489720
1-chloro-9-methoxyphenanthrene
CID 174558891
6,7-dichloro-1,4,9,10-tetramethoxyanthracene
CID 139930251
7-(8-hydroxy-1,4-dimethoxy-3-methylnaphthalen-2-yl)-5,8-dimethoxy-6-methylnaphthalen-1-ol
CID 13468240
N'-(4-chloro-2,5-dimethoxyphenyl)-N-(5-hydroxynaphthalen-1-yl)oxamide
CID 108509414
1-hydroxy-3,4,5-trimethoxyxanthen-9-one
CID 72944463
2-chloro-5-(2,3-dimethoxyphenyl)phenol
CID 83130708
11-chloro-1-hydroxy-12-methoxynaphtho[1,2-c]isochromen-6-one
CID 146018204
1,5,8-trihydroxy-3,4-dimethoxyxanthen-9-one
CID 86183532
4-chloro-2-methoxy-5-phenylphenol
CID 132557870

Frequently Asked Questions

What is the IUPAC name of 5-chloro-7,8-dimethoxynaphthalen-1-ol?
The IUPAC name of 5-chloro-7,8-dimethoxynaphthalen-1-ol (CID 86132607) is 5-chloro-7,8-dimethoxynaphthalen-1-ol.
What is the SMILES notation for 5-chloro-7,8-dimethoxynaphthalen-1-ol?
The canonical SMILES for 5-chloro-7,8-dimethoxynaphthalen-1-ol is COc1cc(Cl)c2cccc(O)c2c1OC.
What is the InChIKey of 5-chloro-7,8-dimethoxynaphthalen-1-ol?
The InChIKey is RXQFAJOMCFNMMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClO3/c1-15-10-6-8(13)7-4-3-5-9(14)11(7)12(10)16-2/h3-6,14H,1-2H3.
What are the key properties of 5-chloro-7,8-dimethoxynaphthalen-1-ol?
5-chloro-7,8-dimethoxynaphthalen-1-ol has a molecular weight of 238.67 g/mol, XLogP of 3.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-7,8-dimethoxynaphthalen-1-ol is sourced from PubChem (CID 86132607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).