(4-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methanol
Basic information
- CAS
5448-32-8- Standard SMILES
CC1(CO)COC(c2ccccc2)=N1- InChIKey
AMAGYPIRQVGAAS-UHFFFAOYSA-N- Molecular formula
- C11H13NO2
- Average molar mass
- 191.23 g/mol
- Monoisotopic mass
- 191.09462866
Names & identifiers
- Preferred name
- (4-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methanol
- IUPAC
- (4-methyl-2-phenyl-5H-1,3-oxazol-4-yl)methanol
- English name
- (4-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methanol
- Molecular formula
- C11H13NO2
- Molecular weight
- 191.23
Names & synonyms
5448-32-8(4-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methanolDTXSID90280637RefChem:208913DTXCID00231791(4-methyl-2-phenyl-5H-1,3-oxazol-4-yl)methanol4-Oxazolemethanol,4,5-dihydro-4-methyl-2-phenyl-(4-Methyl-2-phenyl-4,5-dihydrooxazol-4-yl)methanol4-hydroxymethyl-4-methyl-2-phenyloxazoline(4-methyl-2-phenyl-1,3-oxazolin-4-yl)methan-1-olNSC177374-Oxazolemethanol, 4,5-dihydro-4-methyl-2-phenyl-
Show more names
(4-methyl-2-phenyl-5H-oxazol-4-yl)methanol
MLS000729344CHEMBL1897616SCHEMBL12471989HMS2750H05NSC-17737SBB071870AKOS001757072SMR000307622
Database identifiers
- CAS
5448-32-8- PubChem CID
- 226853
- DTXSID
DTXSID90280637- ChEMBL
CHEMBL1897616
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 41.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 233
Experimental & physicochemical properties
Solubility>28.7 [ug/mL] (The mean of the results at pH 7.4)
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Related reactions
2 records
Compound notes
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