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

C9H6ClNO3 — CID 117260222

IUPAC2-[(5-chloro-1,3-oxazol-2-yl)oxy]phenol
SMILESOc1ccccc1Oc1ncc(Cl)o1
InChIInChI=1S/C9H6ClNO3/c10-8-5-11-9(14-8)13-7-4-2-1-3-6(7)12/h1-5,12H
InChIKeyYOKRRGFYYHMHNN-UHFFFAOYSA-N
MW211.60 g/mol
LogP2.83
Rot. Bonds2

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

2-[(5-chloro-1,3-oxazol-2-yl)oxy]phenol (PubChem CID 117260222) has the molecular formula C9H6ClNO3 and a molecular weight of 211.60 g/mol. Its IUPAC name is 2-[(5-chloro-1,3-oxazol-2-yl)oxy]phenol.

Molecular Properties

Compound Name2-[(5-chloro-1,3-oxazol-2-yl)oxy]phenol
PubChem CID117260222
Molecular FormulaC9H6ClNO3
Molecular Weight211.60 g/mol
Exact Mass211.00
IUPAC Name2-[(5-chloro-1,3-oxazol-2-yl)oxy]phenol
SMILESOc1ccccc1Oc1ncc(Cl)o1
InChIInChI=1S/C9H6ClNO3/c10-8-5-11-9(14-8)13-7-4-2-1-3-6(7)12/h1-5,12H
InChIKeyYOKRRGFYYHMHNN-UHFFFAOYSA-N
XLogP2.83
TPSA55.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.60
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-hydroxyphenoxy)phenol;phosphane
CID 174791785
2-[(5-bromo-3-chloro-2-pyridinyl)oxy]phenol
CID 103582945
2-quinoxalin-2-yloxyphenol
CID 13328504
2-(1-methylimidazol-2-yl)oxyphenol
CID 62133680
2-[2,3-bis(2-hydroxyphenoxy)phenoxy]phenol
CID 139940614
2-[(2-bromo-1,3-thiazol-5-yl)methoxy]phenol
CID 117192622
2-[(3,5-difluoro-2-pyridinyl)oxy]phenol
CID 112676281
2-(2-hydroxyphenoxy)-3-methylimidazole-4-carboxylic acid
CID 117190460
2-[[3-chloro-5-(trifluoromethyl)-4-pyridinyl]oxy]phenol
CID 23053223
tris(2-hydroxyphenyl) arsorite
CID 139727037
2-[(3-bromo-5-methyl-2-pyridinyl)oxy]phenol
CID 105367477
2-[(5-bromo-1,3-oxazol-2-yl)methoxy]phenol
CID 117187926

Frequently Asked Questions

What is the IUPAC name of 2-[(5-chloro-1,3-oxazol-2-yl)oxy]phenol?
The IUPAC name of 2-[(5-chloro-1,3-oxazol-2-yl)oxy]phenol (CID 117260222) is 2-[(5-chloro-1,3-oxazol-2-yl)oxy]phenol.
What is the SMILES notation for 2-[(5-chloro-1,3-oxazol-2-yl)oxy]phenol?
The canonical SMILES for 2-[(5-chloro-1,3-oxazol-2-yl)oxy]phenol is Oc1ccccc1Oc1ncc(Cl)o1.
What is the InChIKey of 2-[(5-chloro-1,3-oxazol-2-yl)oxy]phenol?
The InChIKey is YOKRRGFYYHMHNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6ClNO3/c10-8-5-11-9(14-8)13-7-4-2-1-3-6(7)12/h1-5,12H.
What are the key properties of 2-[(5-chloro-1,3-oxazol-2-yl)oxy]phenol?
2-[(5-chloro-1,3-oxazol-2-yl)oxy]phenol has a molecular weight of 211.60 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-chloro-1,3-oxazol-2-yl)oxy]phenol is sourced from PubChem (CID 117260222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).