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5-(3-Fluorophenyl)-1,2-oxazole-4-carboxylic acid

HCID 22831709
NotesReactions

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Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
887408-22-2
Standard SMILES
O=C(O)c1cnoc1-c1cccc(F)c1
InChIKey
XFGIXATUJIHBKW-UHFFFAOYSA-N
Molecular formula
C10H6FNO3
Average molar mass
207.16 g/mol
Monoisotopic mass
207.03317127

Names & identifiers

Preferred name
5-(3-Fluorophenyl)-1,2-oxazole-4-carboxylic acid
IUPAC
5-(3-Fluorophenyl)-1,2-oxazole-4-carboxylic acid
English name
5-(3-Fluoro-phenyl)-isoxazole-4-carboxylic acid
Molecular formula
C10H6FNO3
Molecular weight
207.16

Names & synonyms

5-(3-Fluoro-phenyl)-isoxazole-4-carboxylic acid4-Isoxazolecarboxylic acid, 5-(3-fluorophenyl)-

Database identifiers

CAS
887408-22-2
PubChem CID
22831709
DTXSID
DTXSID90628515

Properties

Physicochemical properties

Boiling point
373.1 · 373.1±27.0 °C(Predicted)
Density
1.404 · 1.404±0.06 g/cm3(Predicted)
pka
2.83 · 2.83±0.36(Predicted)

Chemistry & industry

Suppliers2 total

郑州为易化工产品有限公司0371-88888888 qq272369594;2159423853qq · [email protected]
上海兰科化学有限公司021-61916491 15921747686 · [email protected]

Related reactions

2 records
New reaction record
HRID 1446304 reaction equation
HRID 1446304As reactantuspto-grants-2010_02
HRID 1567963 reaction equation
HRID 1567963As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

Compound notes

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