4-[3-(4-hydroxyphenyl)-1,2-oxazol-5-yl]phenol

C15H11NO3 — CID 135855808

IUPAC4-[3-(4-hydroxyphenyl)-1,2-oxazol-5-yl]phenol
SMILESOc1ccc(-c2cc(-c3ccc(O)cc3)on2)cc1
InChIInChI=1S/C15H11NO3/c17-12-5-1-10(2-6-12)14-9-15(19-16-14)11-3-7-13(18)8-4-11/h1-9,17-18H
InChIKeyRPSOIFGUBMMKIO-UHFFFAOYSA-N
MW253.26 g/mol
LogP3.42
Rot. Bonds2

About 4-[3-(4-hydroxyphenyl)-1,2-oxazol-5-yl]phenol

4-[3-(4-hydroxyphenyl)-1,2-oxazol-5-yl]phenol (PubChem CID 135855808) has the molecular formula C15H11NO3 and a molecular weight of 253.26 g/mol. Its IUPAC name is 4-[3-(4-hydroxyphenyl)-1,2-oxazol-5-yl]phenol.

Molecular Properties

Compound Name4-[3-(4-hydroxyphenyl)-1,2-oxazol-5-yl]phenol
PubChem CID135855808
Molecular FormulaC15H11NO3
Molecular Weight253.26 g/mol
Exact Mass253.07
IUPAC Name4-[3-(4-hydroxyphenyl)-1,2-oxazol-5-yl]phenol
SMILESOc1ccc(-c2cc(-c3ccc(O)cc3)on2)cc1
InChIInChI=1S/C15H11NO3/c17-12-5-1-10(2-6-12)14-9-15(19-16-14)11-3-7-13(18)8-4-11/h1-9,17-18H
InChIKeyRPSOIFGUBMMKIO-UHFFFAOYSA-N
XLogP3.42
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3,5-Diphenylisoxazole
CID 137292
(5-Phenyl-1,2-oxazol-3-yl)methanol
CID 1481082
3-Methyl-5-phenylisoxazole
CID 136804
4-(6-Hydroxy-benzo[D]isoxazol-3-YL)benzene-1,3-diol
CID 5287464
5-Methyl-3,4-diphenyl-isoxazole
CID 9991673
Isoxazole, 5-(4-methoxyphenyl)-3-phenyl-
CID 279122
3,4-Diphenyl-5-ethylisoxazole
CID 10377376
3-(3,5-Dimethyl-1,2-Oxazol-4-Yl)-5-[(S)-Hydroxy(Phenyl)methyl]phenol
CID 70699441
3-(2-Hydroxy-phenyl)-benzo[d]isoxazol-6-ol
CID 135474202
3-(4-Hydroxy-phenyl)-benzo[d]isoxazol-5-ol
CID 135474625
4-Benzo[d]isoxazol-3-yl-benzene-1,3-diol
CID 135496123
3-(4-Hydroxy-phenyl)-benzo[d]isoxazol-6-ol
CID 135526958

Frequently Asked Questions

What is the IUPAC name of 4-[3-(4-hydroxyphenyl)-1,2-oxazol-5-yl]phenol?
The IUPAC name of 4-[3-(4-hydroxyphenyl)-1,2-oxazol-5-yl]phenol (CID 135855808) is 4-[3-(4-hydroxyphenyl)-1,2-oxazol-5-yl]phenol.
What is the SMILES notation for 4-[3-(4-hydroxyphenyl)-1,2-oxazol-5-yl]phenol?
The canonical SMILES for 4-[3-(4-hydroxyphenyl)-1,2-oxazol-5-yl]phenol is Oc1ccc(-c2cc(-c3ccc(O)cc3)on2)cc1.
What is the InChIKey of 4-[3-(4-hydroxyphenyl)-1,2-oxazol-5-yl]phenol?
The InChIKey is RPSOIFGUBMMKIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11NO3/c17-12-5-1-10(2-6-12)14-9-15(19-16-14)11-3-7-13(18)8-4-11/h1-9,17-18H.
What are the key properties of 4-[3-(4-hydroxyphenyl)-1,2-oxazol-5-yl]phenol?
4-[3-(4-hydroxyphenyl)-1,2-oxazol-5-yl]phenol has a molecular weight of 253.26 g/mol, XLogP of 3.42, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(4-hydroxyphenyl)-1,2-oxazol-5-yl]phenol is sourced from PubChem (CID 135855808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).