2-[(5-chloro-1,1-dioxo-1,3-thiazol-2-yl)oxy]phenol

C9H6ClNO4S — CID 117260259

IUPAC2-[(5-chloro-1,1-dioxo-1,3-thiazol-2-yl)oxy]phenol
SMILESO=S1(=O)C(Cl)=CN=C1Oc1ccccc1O
InChIInChI=1S/C9H6ClNO4S/c10-8-5-11-9(16(8,13)14)15-7-4-2-1-3-6(7)12/h1-5,12H
InChIKeyRXBSLSMIYLDAON-UHFFFAOYSA-N
MW259.67 g/mol
LogP1.59
Rot. Bonds1

About 2-[(5-chloro-1,1-dioxo-1,3-thiazol-2-yl)oxy]phenol

2-[(5-chloro-1,1-dioxo-1,3-thiazol-2-yl)oxy]phenol (PubChem CID 117260259) has the molecular formula C9H6ClNO4S and a molecular weight of 259.67 g/mol. Its IUPAC name is 2-[(5-chloro-1,1-dioxo-1,3-thiazol-2-yl)oxy]phenol.

Molecular Properties

Compound Name2-[(5-chloro-1,1-dioxo-1,3-thiazol-2-yl)oxy]phenol
PubChem CID117260259
Molecular FormulaC9H6ClNO4S
Molecular Weight259.67 g/mol
Exact Mass258.97
IUPAC Name2-[(5-chloro-1,1-dioxo-1,3-thiazol-2-yl)oxy]phenol
SMILESO=S1(=O)C(Cl)=CN=C1Oc1ccccc1O
InChIInChI=1S/C9H6ClNO4S/c10-8-5-11-9(16(8,13)14)15-7-4-2-1-3-6(7)12/h1-5,12H
InChIKeyRXBSLSMIYLDAON-UHFFFAOYSA-N
XLogP1.59
TPSA75.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.67
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-hydroxyphenoxy)phenol;phosphane
CID 174791785
2-(3-chlorophenoxy)-1,1-dioxo-1,3-thiazol-5-amine
CID 117190258
(2-hydroxyphenyl) 3-chlorobenzoate
CID 4525221
2-[(2-methyl-1,1-dioxo-1,3-thiazol-5-yl)methoxy]phenol
CID 117192456
2-[(5-bromo-3-chloro-2-pyridinyl)oxy]phenol
CID 103582945
2-(2-amino-4-chlorophenoxy)phenol
CID 130156009
2-[6-(2-hydroxyphenoxy)naphthalen-2-yl]oxyphenol
CID 175775609
4-[(5-bromo-1,1-dioxo-1,3-thiazol-2-yl)oxy]phenol
CID 117190288
2-[(5-chloro-1,3-oxazol-2-yl)oxy]phenol
CID 117260222
2-(4,6-dimethylpyrimidin-2-yl)oxyphenol
CID 60868956
2-[2,3-bis(2-hydroxyphenoxy)phenoxy]phenol
CID 139940614
4-chloro-2-(2-hydroxyphenoxy)-1,3-thiazole-5-carboxylic acid
CID 117258721

Frequently Asked Questions

What is the IUPAC name of 2-[(5-chloro-1,1-dioxo-1,3-thiazol-2-yl)oxy]phenol?
The IUPAC name of 2-[(5-chloro-1,1-dioxo-1,3-thiazol-2-yl)oxy]phenol (CID 117260259) is 2-[(5-chloro-1,1-dioxo-1,3-thiazol-2-yl)oxy]phenol.
What is the SMILES notation for 2-[(5-chloro-1,1-dioxo-1,3-thiazol-2-yl)oxy]phenol?
The canonical SMILES for 2-[(5-chloro-1,1-dioxo-1,3-thiazol-2-yl)oxy]phenol is O=S1(=O)C(Cl)=CN=C1Oc1ccccc1O.
What is the InChIKey of 2-[(5-chloro-1,1-dioxo-1,3-thiazol-2-yl)oxy]phenol?
The InChIKey is RXBSLSMIYLDAON-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6ClNO4S/c10-8-5-11-9(16(8,13)14)15-7-4-2-1-3-6(7)12/h1-5,12H.
What are the key properties of 2-[(5-chloro-1,1-dioxo-1,3-thiazol-2-yl)oxy]phenol?
2-[(5-chloro-1,1-dioxo-1,3-thiazol-2-yl)oxy]phenol has a molecular weight of 259.67 g/mol, XLogP of 1.59, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-chloro-1,1-dioxo-1,3-thiazol-2-yl)oxy]phenol is sourced from PubChem (CID 117260259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).