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Isoxazoles

Aromatic organic heterocyclic compounds that consist of an azole with a nitrogen atom and an oxygen atom with the formula: C3H3NO.
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1

Ethyl 5-(hydroxymethyl)isoxazole-3-carboxylate, 90%, Thermo Scientific™

CAS: 123770-62-7 Molecular Formula: C7H9NO4 Molecular Weight (g/mol): 171.152 MDL Number: MFCD08273501 InChI Key: ZWVVVEYXDQMHGQ-UHFFFAOYSA-N Synonym: ethyl 5-hydroxymethyl isoxazole-3-carboxylate,ethyl 5-hydroxymethyl-1,2-oxazole-3-carboxylate,5-hydroxymethylisoxazole-3-carboxylic acid ethyl ester,3-isoxazolecarboxylicacid, 5-hydroxymethyl-, ethyl ester,3-isoxazolecarboxylic acid, 5-hydroxymethyl-, ethyl ester,acmc-1c7ap,ethyl 5-hydroxymethylisoxazole-3-carboxylate,ethyl 5 hydroxymethyl isoxazole-3-carboxylate,ethyl 5-hydroxymethyl-isoxazole-3-carboxylate PubChem CID: 8027233 IUPAC Name: ethyl 5-(hydroxymethyl)-1,2-oxazole-3-carboxylate SMILES: CCOC(=O)C1=NOC(=C1)CO

PubChem CID 8027233
CAS 123770-62-7
Molecular Weight (g/mol) 171.152
MDL Number MFCD08273501
SMILES CCOC(=O)C1=NOC(=C1)CO
Synonym ethyl 5-hydroxymethyl isoxazole-3-carboxylate,ethyl 5-hydroxymethyl-1,2-oxazole-3-carboxylate,5-hydroxymethylisoxazole-3-carboxylic acid ethyl ester,3-isoxazolecarboxylicacid, 5-hydroxymethyl-, ethyl ester,3-isoxazolecarboxylic acid, 5-hydroxymethyl-, ethyl ester,acmc-1c7ap,ethyl 5-hydroxymethylisoxazole-3-carboxylate,ethyl 5 hydroxymethyl isoxazole-3-carboxylate,ethyl 5-hydroxymethyl-isoxazole-3-carboxylate
IUPAC Name ethyl 5-(hydroxymethyl)-1,2-oxazole-3-carboxylate
InChI Key ZWVVVEYXDQMHGQ-UHFFFAOYSA-N
Molecular Formula C7H9NO4
2

5-Methyl-3-phenylisoxazole-4-carbonyl chloride, 90%, Thermo Scientific™

CAS: 16883-16-2 Molecular Formula: C11H8ClNO2 Molecular Weight (g/mol): 221.64 MDL Number: MFCD00052205 InChI Key: HXEVQMXCHCDPSO-UHFFFAOYSA-N Synonym: 5-methyl-3-phenylisoxazole-4-carbonyl chloride,pmic chloride,unii-97ot2t1w6v,3-phenyl-5-methylisoxazole-4-carbonyl chloride,4-isoxazolecarbonyl chloride, 5-methyl-3-phenyl,5-methyl-3-phenyl-4-isoxazolecarbonyl chloride,3-phenyl-5-methyl-isoxazole-4-carbonyl,pubchem8723,acmc-20am25,dsstox_cid_31452 PubChem CID: 85624 IUPAC Name: 5-methyl-3-phenyl-1,2-oxazole-4-carbonyl chloride SMILES: CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)Cl

PubChem CID 85624
CAS 16883-16-2
Molecular Weight (g/mol) 221.64
MDL Number MFCD00052205
SMILES CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)Cl
Synonym 5-methyl-3-phenylisoxazole-4-carbonyl chloride,pmic chloride,unii-97ot2t1w6v,3-phenyl-5-methylisoxazole-4-carbonyl chloride,4-isoxazolecarbonyl chloride, 5-methyl-3-phenyl,5-methyl-3-phenyl-4-isoxazolecarbonyl chloride,3-phenyl-5-methyl-isoxazole-4-carbonyl,pubchem8723,acmc-20am25,dsstox_cid_31452
IUPAC Name 5-methyl-3-phenyl-1,2-oxazole-4-carbonyl chloride
InChI Key HXEVQMXCHCDPSO-UHFFFAOYSA-N
Molecular Formula C11H8ClNO2
3

5-Phenylisoxazole-3-carboxylic Acid 98.0+%, TCI America™

CAS: 14441-90-8 Molecular Formula: C10H7NO3 Molecular Weight (g/mol): 189.17 MDL Number: MFCD00464221 InChI Key: XJYOBHXWBRKOQO-UHFFFAOYSA-N Synonym: 5-phenylisoxazole-3-carboxylic acid,5-phenyl-isoxazole-3-carboxylic acid,5-phenyl-3-isoxazolecarboxylic acid,3-isoxazolecarboxylic acid, 5-phenyl,3-isoxazolecarboxylicacid, 5-phenyl,5-phenylisoxazole-3-carboxylicacid,5-phenylisoxazol-3-carboxylic acid PubChem CID: 151916 IUPAC Name: 5-phenyl-1,2-oxazole-3-carboxylic acid SMILES: C1=CC=C(C=C1)C2=CC(=NO2)C(=O)O

PubChem CID 151916
CAS 14441-90-8
Molecular Weight (g/mol) 189.17
MDL Number MFCD00464221
SMILES C1=CC=C(C=C1)C2=CC(=NO2)C(=O)O
Synonym 5-phenylisoxazole-3-carboxylic acid,5-phenyl-isoxazole-3-carboxylic acid,5-phenyl-3-isoxazolecarboxylic acid,3-isoxazolecarboxylic acid, 5-phenyl,3-isoxazolecarboxylicacid, 5-phenyl,5-phenylisoxazole-3-carboxylicacid,5-phenylisoxazol-3-carboxylic acid
IUPAC Name 5-phenyl-1,2-oxazole-3-carboxylic acid
InChI Key XJYOBHXWBRKOQO-UHFFFAOYSA-N
Molecular Formula C10H7NO3
4

3,5-Dimethylisoxazole-4-carbonyl Chloride 96.0+%, TCI America™

CAS: 31301-45-8 Molecular Formula: C6H6ClNO2 Molecular Weight (g/mol): 159.569 MDL Number: MFCD00052555 InChI Key: MPYGFFPGJMGVSW-UHFFFAOYSA-N Synonym: 3,5-dimethylisoxazole-4-carbonyl chloride,4-isoxazolecarbonyl chloride, 3,5-dimethyl,3,5-dimethylisoxazole-4-carbonylchloride,dimethyl-1,2-oxazole-4-carbonyl chloride,3,5-dimethyl-4-isoxazolecarbonyl chloride,pubchem8669,acmc-20a3wc,3,5-dimethylisoxasole-4-carbonyl chloride,3,5-dimethyisoxazole-4-carbonyl chloride,3,5 dimethylisoxazole-4-carbonyl chloride PubChem CID: 2736265 IUPAC Name: 3,5-dimethyl-1,2-oxazole-4-carbonyl chloride SMILES: CC1=C(C(=NO1)C)C(=O)Cl

PubChem CID 2736265
CAS 31301-45-8
Molecular Weight (g/mol) 159.569
MDL Number MFCD00052555
SMILES CC1=C(C(=NO1)C)C(=O)Cl
Synonym 3,5-dimethylisoxazole-4-carbonyl chloride,4-isoxazolecarbonyl chloride, 3,5-dimethyl,3,5-dimethylisoxazole-4-carbonylchloride,dimethyl-1,2-oxazole-4-carbonyl chloride,3,5-dimethyl-4-isoxazolecarbonyl chloride,pubchem8669,acmc-20a3wc,3,5-dimethylisoxasole-4-carbonyl chloride,3,5-dimethyisoxazole-4-carbonyl chloride,3,5 dimethylisoxazole-4-carbonyl chloride
IUPAC Name 3,5-dimethyl-1,2-oxazole-4-carbonyl chloride
InChI Key MPYGFFPGJMGVSW-UHFFFAOYSA-N
Molecular Formula C6H6ClNO2
5

Chemscene ChemScene | 5-Phenylisoxazole-3-carboxylic acid | 5G | CS-W022424 | 0.97 | 14441-90-8| MFCD00464221 | 189.17
SDP

ChemScene | 5-Phenylisoxazole-3-carboxylic acid | 5G | CS-W022424 | 0.97 | 14441-90-8| MFCD00464221 | 189.17

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