(5-phenyl-1,2-oxazol-3-yl)methanol

C10H9NO2 — CID 1481082

IUPAC(5-phenyl-1,2-oxazol-3-yl)methanol
SMILESOCc1cc(-c2ccccc2)on1
InChIInChI=1S/C10H9NO2/c12-7-9-6-10(13-11-9)8-4-2-1-3-5-8/h1-6,12H,7H2
InChIKeyBPAFLGGUEBMWRN-UHFFFAOYSA-N
MW175.19 g/mol
LogP1.83
Rot. Bonds2

About (5-phenyl-1,2-oxazol-3-yl)methanol

(5-phenyl-1,2-oxazol-3-yl)methanol (PubChem CID 1481082) has the molecular formula C10H9NO2 and a molecular weight of 175.19 g/mol. Its IUPAC name is (5-phenyl-1,2-oxazol-3-yl)methanol.

Molecular Properties

Compound Name(5-phenyl-1,2-oxazol-3-yl)methanol
PubChem CID1481082
Molecular FormulaC10H9NO2
Molecular Weight175.19 g/mol
Exact Mass175.06
IUPAC Name(5-phenyl-1,2-oxazol-3-yl)methanol
SMILESOCc1cc(-c2ccccc2)on1
InChIInChI=1S/C10H9NO2/c12-7-9-6-10(13-11-9)8-4-2-1-3-5-8/h1-6,12H,7H2
InChIKeyBPAFLGGUEBMWRN-UHFFFAOYSA-N
XLogP1.83
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5-phenyl-1,2-oxazol-3-yl)methanol?
The IUPAC name of (5-phenyl-1,2-oxazol-3-yl)methanol (CID 1481082) is (5-phenyl-1,2-oxazol-3-yl)methanol.
What is the SMILES notation for (5-phenyl-1,2-oxazol-3-yl)methanol?
The canonical SMILES for (5-phenyl-1,2-oxazol-3-yl)methanol is OCc1cc(-c2ccccc2)on1.
What is the InChIKey of (5-phenyl-1,2-oxazol-3-yl)methanol?
The InChIKey is BPAFLGGUEBMWRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO2/c12-7-9-6-10(13-11-9)8-4-2-1-3-5-8/h1-6,12H,7H2.
What are the key properties of (5-phenyl-1,2-oxazol-3-yl)methanol?
(5-phenyl-1,2-oxazol-3-yl)methanol has a molecular weight of 175.19 g/mol, XLogP of 1.83, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-phenyl-1,2-oxazol-3-yl)methanol is sourced from PubChem (CID 1481082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).