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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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Forme physique

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1 – 15 de 55 résultats
1

4-(Bromomethyl)-5-methyl-3-phenylisoxazole, 97%, Thermo Scientific™

CAS: 180597-83-5 Formule moléculaire: C11H10BrNO Poids moléculaire (g/mol): 252.11 Numéro MDL: MFCD02677680 Clé InChI: UICMWXWMCOJBIQ-UHFFFAOYSA-N CID PubChem: 2776147 Nom IUPAC: 4-(bromomethyl)-5-methyl-3-phenyl-1,2-oxazole SMILES: CC1=C(CBr)C(=NO1)C1=CC=CC=C1

Poids moléculaire (g/mol) 252.11
Numéro MDL MFCD02677680
CAS 180597-83-5
CID PubChem 2776147
Nom IUPAC 4-(bromomethyl)-5-methyl-3-phenyl-1,2-oxazole
Clé InChI UICMWXWMCOJBIQ-UHFFFAOYSA-N
SMILES CC1=C(CBr)C(=NO1)C1=CC=CC=C1
Formule moléculaire C11H10BrNO
2

3-(Bromomethyl)-5-methylisoxazole, 97%, Thermo Scientific™

CAS: 130628-75-0 Formule moléculaire: C5H6BrNO Poids moléculaire (g/mol): 176.01 Numéro MDL: MFCD02677720 Clé InChI: ASGJFGPILHALRC-UHFFFAOYSA-N Synonyme: 3-bromomethyl-5-methylisoxazole,3-bromomethyl-5-methyl-1,2-oxazole,3-bromomethyl-5-methyl-isoxazole,isoxazole,3-bromomethyl-5-methyl,zlchem 1313,acmc-1ca86,3-bromomethyl-5-methylisoxazol,5-brimomethyl-3-methylisoxazle CID PubChem: 2776304 Nom IUPAC: 3-(bromomethyl)-5-methyl-1,2-oxazole SMILES: CC1=CC(CBr)=NO1

Poids moléculaire (g/mol) 176.01
Synonyme 3-bromomethyl-5-methylisoxazole,3-bromomethyl-5-methyl-1,2-oxazole,3-bromomethyl-5-methyl-isoxazole,isoxazole,3-bromomethyl-5-methyl,zlchem 1313,acmc-1ca86,3-bromomethyl-5-methylisoxazol,5-brimomethyl-3-methylisoxazle
Numéro MDL MFCD02677720
CAS 130628-75-0
CID PubChem 2776304
Nom IUPAC 3-(bromomethyl)-5-methyl-1,2-oxazole
Clé InChI ASGJFGPILHALRC-UHFFFAOYSA-N
SMILES CC1=CC(CBr)=NO1
Formule moléculaire C5H6BrNO
3

3-Methylisoxazole-5-carboxylic acid, 97%

CAS: 4857-42-5 Formule moléculaire: C5H5NO3 Poids moléculaire (g/mol): 127.099 Numéro MDL: MFCD00464222 Clé InChI: HXIYCKAAQPHZBM-UHFFFAOYSA-N Synonyme: 3-methylisoxazole-5-carboxylic acid,3-methyl-5-isoxazolecarboxylic acid,5-isoxazolecarboxylic acid, 3-methyl,3-methyl-isoxazole-5-carboxylic acid,5-carboxy-3-methylisoxazole,5-isoxazolecarboxylicacid, 3-methyl,3-methylisoxazole-5-carboxylicacid,acmc-1aruu,3-methyl-5-carboxyisoxazole,aronis24519 CID PubChem: 853085 Nom IUPAC: 3-methyl-1,2-oxazole-5-carboxylic acid SMILES: CC1=NOC(=C1)C(=O)O

Poids moléculaire (g/mol) 127.099
Synonyme 3-methylisoxazole-5-carboxylic acid,3-methyl-5-isoxazolecarboxylic acid,5-isoxazolecarboxylic acid, 3-methyl,3-methyl-isoxazole-5-carboxylic acid,5-carboxy-3-methylisoxazole,5-isoxazolecarboxylicacid, 3-methyl,3-methylisoxazole-5-carboxylicacid,acmc-1aruu,3-methyl-5-carboxyisoxazole,aronis24519
Numéro MDL MFCD00464222
CAS 4857-42-5
CID PubChem 853085
Nom IUPAC 3-methyl-1,2-oxazole-5-carboxylic acid
Clé InChI HXIYCKAAQPHZBM-UHFFFAOYSA-N
SMILES CC1=NOC(=C1)C(=O)O
Formule moléculaire C5H5NO3
4

5-Amino-3-methylisoxazole, 98%

CAS: 14678-02-5 Formule moléculaire: C4H6N2O Poids moléculaire (g/mol): 98.105 Numéro MDL: MFCD00003151 Clé InChI: FNXYWHTZDAVRTB-UHFFFAOYSA-N Synonyme: 5-amino-3-methylisoxazole,3-methylisoxazol-5-amine,5-isoxazolamine, 3-methyl,3-methyl-5-isoxazolamine,unii-0g66r1h4rw,3-methyl-isoxazol-5-ylamine,3-methylisoxazole-5-ylamine,3-methylisoxazole-5-amine,acmc-209yk8,3-methylisooxazole-5-amine CID PubChem: 84590 Nom IUPAC: 3-methyl-1,2-oxazol-5-amine SMILES: CC1=NOC(=C1)N

Poids moléculaire (g/mol) 98.105
Synonyme 5-amino-3-methylisoxazole,3-methylisoxazol-5-amine,5-isoxazolamine, 3-methyl,3-methyl-5-isoxazolamine,unii-0g66r1h4rw,3-methyl-isoxazol-5-ylamine,3-methylisoxazole-5-ylamine,3-methylisoxazole-5-amine,acmc-209yk8,3-methylisooxazole-5-amine
Numéro MDL MFCD00003151
CAS 14678-02-5
CID PubChem 84590
Nom IUPAC 3-methyl-1,2-oxazol-5-amine
Clé InChI FNXYWHTZDAVRTB-UHFFFAOYSA-N
SMILES CC1=NOC(=C1)N
Formule moléculaire C4H6N2O
5

3-Ethyl-5-methylisoxazole-4-carboxylic acid, 97%

CAS: 17147-85-2 Formule moléculaire: C7H9NO3 Poids moléculaire (g/mol): 155.153 Numéro MDL: MFCD03422293 Clé InChI: RSWFHHWVFZWIMV-UHFFFAOYSA-N Synonyme: 3-ethyl-5-methylisoxazole-4-carboxylic acid,3-ethyl-5-methyl-isoxazole-4-carboxylic acid,3-ethyl-5-methyl-4-isoxazolecarboxylic acid,4-isoxazolecarboxylic acid, 3-ethyl-5-methyl,acmc-1c8pz,4-isoxazolecarboxylicacid,3-ethyl-5-methyl,4-isoxazolecarboxylicacid, 3-ethyl-5-methyl,4-isoxazolecarboxylic acid, 3-ethyl-5-methyl-8ci,9ci CID PubChem: 2063310 Nom IUPAC: 3-ethyl-5-methyl-1,2-oxazole-4-carboxylic acid SMILES: CCC1=NOC(=C1C(=O)O)C

Poids moléculaire (g/mol) 155.153
Synonyme 3-ethyl-5-methylisoxazole-4-carboxylic acid,3-ethyl-5-methyl-isoxazole-4-carboxylic acid,3-ethyl-5-methyl-4-isoxazolecarboxylic acid,4-isoxazolecarboxylic acid, 3-ethyl-5-methyl,acmc-1c8pz,4-isoxazolecarboxylicacid,3-ethyl-5-methyl,4-isoxazolecarboxylicacid, 3-ethyl-5-methyl,4-isoxazolecarboxylic acid, 3-ethyl-5-methyl-8ci,9ci
Numéro MDL MFCD03422293
CAS 17147-85-2
CID PubChem 2063310
Nom IUPAC 3-ethyl-5-methyl-1,2-oxazole-4-carboxylic acid
Clé InChI RSWFHHWVFZWIMV-UHFFFAOYSA-N
SMILES CCC1=NOC(=C1C(=O)O)C
Formule moléculaire C7H9NO3
6

3-Hydroxy-5-methylisoxazole, 97%

CAS: 10004-44-1 Formule moléculaire: C4H5NO2 Poids moléculaire (g/mol): 99.089 Numéro MDL: MFCD00144468 Clé InChI: KGVPNLBXJKTABS-UHFFFAOYSA-N Synonyme: hymexazol,3-hydroxy-5-methylisoxazole,hymexazole,5-methylisoxazol-3-ol,5-methylisoxazol-3 2h-one,hydroxyisoxazole,tachigaren,itachigarden,5-methyl-3-hydroxyisoxazole,5-methyl-3 2h-isoxazolone CID PubChem: 24781 ChEBI: CHEBI:5827 Nom IUPAC: 5-methyl-1,2-oxazol-3-one SMILES: CC1=CC(=O)NO1

Poids moléculaire (g/mol) 99.089
Synonyme hymexazol,3-hydroxy-5-methylisoxazole,hymexazole,5-methylisoxazol-3-ol,5-methylisoxazol-3 2h-one,hydroxyisoxazole,tachigaren,itachigarden,5-methyl-3-hydroxyisoxazole,5-methyl-3 2h-isoxazolone
Numéro MDL MFCD00144468
CAS 10004-44-1
CID PubChem 24781
ChEBI CHEBI:5827
Nom IUPAC 5-methyl-1,2-oxazol-3-one
Clé InChI KGVPNLBXJKTABS-UHFFFAOYSA-N
SMILES CC1=CC(=O)NO1
Formule moléculaire C4H5NO2
7

3,5-Dimethylisoxazole, 99%

CAS: 300-87-8 Formule moléculaire: C5H7NO Poids moléculaire (g/mol): 97.117 Numéro MDL: MFCD00003156 Clé InChI: FICAQKBMCKEFDI-UHFFFAOYSA-N Synonyme: 3,5-dimethylisoxazole,isoxazole, 3,5-dimethyl,3,5-dimethylisooxazole,3,5-dwumetyloizoksazolu,3,5-dwumetyloizoksazolu polish,3,5-dimethylisoxazol,pubchem8641,isoxazole,5-dimethyl,3,5-dimethyl-isoxazole CID PubChem: 9312 Nom IUPAC: 3,5-dimethyl-1,2-oxazole SMILES: CC1=CC(=NO1)C

Poids moléculaire (g/mol) 97.117
Synonyme 3,5-dimethylisoxazole,isoxazole, 3,5-dimethyl,3,5-dimethylisooxazole,3,5-dwumetyloizoksazolu,3,5-dwumetyloizoksazolu polish,3,5-dimethylisoxazol,pubchem8641,isoxazole,5-dimethyl,3,5-dimethyl-isoxazole
Numéro MDL MFCD00003156
CAS 300-87-8
CID PubChem 9312
Nom IUPAC 3,5-dimethyl-1,2-oxazole
Clé InChI FICAQKBMCKEFDI-UHFFFAOYSA-N
SMILES CC1=CC(=NO1)C
Formule moléculaire C5H7NO
8

3,5-Dimethylisoxazol-4-yl isocyanate, 95%, Thermo Scientific™

CAS: 131825-41-7 Formule moléculaire: C6H6N2O2 Poids moléculaire (g/mol): 138.126 Numéro MDL: MFCD00119910 Clé InChI: JJQYAGYVYNMYGE-UHFFFAOYSA-N Synonyme: 3,5-dimethylisoxazol-4-yl isocyanate,isoxazole,4-isocyanato-3,5-dimethyl,3,5-dimethylisoxazole-4-isocyanate,4-isocyanato-3,5-dimethylisoxazole,3,5-dimethyl isoxazol-4-yl isocyanate,3,5-dimethylisoxazol-4-ylisocyanate,acmc-20mu97,3,5-dimethylisoxazol-4-isocyanate,3,5-dimethyl-4-isocyanatoisoxazole,4-isocyanato3,5-dimethyl-isoxazole CID PubChem: 2736266 Nom IUPAC: 4-isocyanato-3,5-dimethyl-1,2-oxazole SMILES: CC1=C(C(=NO1)C)N=C=O

Poids moléculaire (g/mol) 138.126
Synonyme 3,5-dimethylisoxazol-4-yl isocyanate,isoxazole,4-isocyanato-3,5-dimethyl,3,5-dimethylisoxazole-4-isocyanate,4-isocyanato-3,5-dimethylisoxazole,3,5-dimethyl isoxazol-4-yl isocyanate,3,5-dimethylisoxazol-4-ylisocyanate,acmc-20mu97,3,5-dimethylisoxazol-4-isocyanate,3,5-dimethyl-4-isocyanatoisoxazole,4-isocyanato3,5-dimethyl-isoxazole
Numéro MDL MFCD00119910
CAS 131825-41-7
CID PubChem 2736266
Nom IUPAC 4-isocyanato-3,5-dimethyl-1,2-oxazole
Clé InChI JJQYAGYVYNMYGE-UHFFFAOYSA-N
SMILES CC1=C(C(=NO1)C)N=C=O
Formule moléculaire C6H6N2O2
9

Isoxazole, 99%

CAS: 288-14-2 Formule moléculaire: C3H3NO Poids moléculaire (g/mol): 69.063 Numéro MDL: MFCD00003149 Clé InChI: CTAPFRYPJLPFDF-UHFFFAOYSA-N Synonyme: isoxazole,1-oxa-2-azacyclopentadiene,isooxazole,unii-00srw0m6pw,00srw0m6pw,isoxazoles,pubchem8623,acmc-209h4x,ksc204o6n CID PubChem: 9254 ChEBI: CHEBI:35595 Nom IUPAC: 1,2-oxazole SMILES: C1=CON=C1

Poids moléculaire (g/mol) 69.063
Synonyme isoxazole,1-oxa-2-azacyclopentadiene,isooxazole,unii-00srw0m6pw,00srw0m6pw,isoxazoles,pubchem8623,acmc-209h4x,ksc204o6n
Numéro MDL MFCD00003149
CAS 288-14-2
CID PubChem 9254
ChEBI CHEBI:35595
Nom IUPAC 1,2-oxazole
Clé InChI CTAPFRYPJLPFDF-UHFFFAOYSA-N
SMILES C1=CON=C1
Formule moléculaire C3H3NO
10

5-Methylisoxazole-3-carbonyl chloride, 98%, Thermo Scientific Chemicals

CAS: 39499-34-8 Formule moléculaire: C5H4ClNO2 Poids moléculaire (g/mol): 145.54 Numéro MDL: MFCD00085127 Clé InChI: XMVNMWDLOGSUSM-UHFFFAOYSA-N Synonyme: 5-methylisoxazole-3-carbonyl chloride,3-isoxazolecarbonyl chloride, 5-methyl,5-methyl-3-isoxazolecarbonyl chloride,5-methyl-isoxazole-3-carbonyl chloride,acmc-209j5v,5-methyl-3-isoxazoyl chloride,5-methylisoxazole carbonyl chloride,5-methylisoxazol-3-ylcarbonyl chloride,3-isoxazolecarbonylchloride, 5-methyl,5-methyl isoxazole-3-carbonyl chloride CID PubChem: 2736894 Nom IUPAC: 5-methyl-1,2-oxazole-3-carbonyl chloride SMILES: CC1=CC(=NO1)C(Cl)=O

Poids moléculaire (g/mol) 145.54
Synonyme 5-methylisoxazole-3-carbonyl chloride,3-isoxazolecarbonyl chloride, 5-methyl,5-methyl-3-isoxazolecarbonyl chloride,5-methyl-isoxazole-3-carbonyl chloride,acmc-209j5v,5-methyl-3-isoxazoyl chloride,5-methylisoxazole carbonyl chloride,5-methylisoxazol-3-ylcarbonyl chloride,3-isoxazolecarbonylchloride, 5-methyl,5-methyl isoxazole-3-carbonyl chloride
Numéro MDL MFCD00085127
CAS 39499-34-8
CID PubChem 2736894
Nom IUPAC 5-methyl-1,2-oxazole-3-carbonyl chloride
Clé InChI XMVNMWDLOGSUSM-UHFFFAOYSA-N
SMILES CC1=CC(=NO1)C(Cl)=O
Formule moléculaire C5H4ClNO2
11

Sulfamethoxazole, 98%

CAS: 723-46-6 Formule moléculaire: C10H11N3O3S Poids moléculaire (g/mol): 253.276 Numéro MDL: MFCD00010546 Clé InChI: JLKIGFTWXXRPMT-UHFFFAOYSA-N Synonyme: sulfamethoxazole,sulphamethoxazole,sulfisomezole,gantanol,sulfamethoxazol,metoxal,sulfamethylisoxazole,simsinomin,radonil,sinomin CID PubChem: 5329 ChEBI: CHEBI:9332 Nom IUPAC: 4-amino-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide SMILES: CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)N

Poids moléculaire (g/mol) 253.276
Synonyme sulfamethoxazole,sulphamethoxazole,sulfisomezole,gantanol,sulfamethoxazol,metoxal,sulfamethylisoxazole,simsinomin,radonil,sinomin
Numéro MDL MFCD00010546
CAS 723-46-6
CID PubChem 5329
ChEBI CHEBI:9332
Nom IUPAC 4-amino-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
Clé InChI JLKIGFTWXXRPMT-UHFFFAOYSA-N
SMILES CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)N
Formule moléculaire C10H11N3O3S
12

Methyl 5-methylisoxazole-3-carboxylate, 97%

CAS: 19788-35-3 Formule moléculaire: C6H7NO3 Poids moléculaire (g/mol): 141.13 Numéro MDL: MFCD00015895 Clé InChI: MVHHQOCEOUNTID-UHFFFAOYSA-N Synonyme: methyl 5-methylisoxazole-3-carboxylate,methyl 5-methyl-3-isoxazolecarboxylate,3-isoxazolecarboxylic acid, 5-methyl-, methyl ester,5-methyl-3-isoxazolecarboxylic acid methyl ester,methyl 5-methyl-3-isoxazole carboxylate,methyl-5-methyl-3-isoxazole carboxylate,5-methylisoxazole-3-carboxylic acid methyl ester,5-methyl-isoxazole-3-carboxylic acid methyl ester,acmc-209xf5,ksc489s1r CID PubChem: 88245 Nom IUPAC: methyl 5-methyl-1,2-oxazole-3-carboxylate SMILES: COC(=O)C1=NOC(C)=C1

Poids moléculaire (g/mol) 141.13
Synonyme methyl 5-methylisoxazole-3-carboxylate,methyl 5-methyl-3-isoxazolecarboxylate,3-isoxazolecarboxylic acid, 5-methyl-, methyl ester,5-methyl-3-isoxazolecarboxylic acid methyl ester,methyl 5-methyl-3-isoxazole carboxylate,methyl-5-methyl-3-isoxazole carboxylate,5-methylisoxazole-3-carboxylic acid methyl ester,5-methyl-isoxazole-3-carboxylic acid methyl ester,acmc-209xf5,ksc489s1r
Numéro MDL MFCD00015895
CAS 19788-35-3
CID PubChem 88245
Nom IUPAC methyl 5-methyl-1,2-oxazole-3-carboxylate
Clé InChI MVHHQOCEOUNTID-UHFFFAOYSA-N
SMILES COC(=O)C1=NOC(C)=C1
Formule moléculaire C6H7NO3
13

(5-Phenylisoxazol-3-yl)methanol, 97%, Thermo Scientific™

CAS: 1619-37-0 Formule moléculaire: C10H9NO2 Poids moléculaire (g/mol): 175.187 Numéro MDL: MFCD01444104 Clé InChI: BPAFLGGUEBMWRN-UHFFFAOYSA-N CID PubChem: 1481082 Nom IUPAC: (5-phenyl-1,2-oxazol-3-yl)methanol SMILES: C1=CC=C(C=C1)C2=CC(=NO2)CO

Poids moléculaire (g/mol) 175.187
Numéro MDL MFCD01444104
CAS 1619-37-0
CID PubChem 1481082
Nom IUPAC (5-phenyl-1,2-oxazol-3-yl)methanol
Clé InChI BPAFLGGUEBMWRN-UHFFFAOYSA-N
SMILES C1=CC=C(C=C1)C2=CC(=NO2)CO
Formule moléculaire C10H9NO2
14

Isoxazole-5-carboxylic acid, 95%, Thermo Scientific™

CAS: 21169-71-1 Formule moléculaire: C4H3NO3 Poids moléculaire (g/mol): 113.072 Numéro MDL: MFCD00156151 Clé InChI: MIIQJAUWHSUTIT-UHFFFAOYSA-N Synonyme: isoxazole-5-carboxylic acid,5-isoxazolecarboxylic acid,isoxazole-5-carboxylicacid,5-carboxyisoxazole,pubchem8643,isoxazole-5-carboxylic,5-carboxy-1,2-oxazole,isoxazole 5-carboxylic acid,ksc207s2h CID PubChem: 2060599 Nom IUPAC: 1,2-oxazole-5-carboxylic acid SMILES: C1=C(ON=C1)C(=O)O

Poids moléculaire (g/mol) 113.072
Synonyme isoxazole-5-carboxylic acid,5-isoxazolecarboxylic acid,isoxazole-5-carboxylicacid,5-carboxyisoxazole,pubchem8643,isoxazole-5-carboxylic,5-carboxy-1,2-oxazole,isoxazole 5-carboxylic acid,ksc207s2h
Numéro MDL MFCD00156151
CAS 21169-71-1
CID PubChem 2060599
Nom IUPAC 1,2-oxazole-5-carboxylic acid
Clé InChI MIIQJAUWHSUTIT-UHFFFAOYSA-N
SMILES C1=C(ON=C1)C(=O)O
Formule moléculaire C4H3NO3
15

Isoxazole-5-carbonyl chloride, 97%

CAS: 62348-13-4 Formule moléculaire: C4H2ClNO2 Poids moléculaire (g/mol): 131.52 Numéro MDL: MFCD00067868 Clé InChI: NASLINFISOTVJJ-UHFFFAOYSA-N Synonyme: isoxazole-5-carbonyl chloride,5-isoxazolecarbonyl chloride,isoxazole-5-carbonylchloride,isoxazole-5-carboxylic acid chloride,acmc-1bhwq,5-isoxazolecarbonylchloride,isoxazol-5-carbonyl chloride,isoxazole-5-carbonyl-chloride,5-isoxazolecarbonyl chloride 9ci CID PubChem: 2736707 Nom IUPAC: 1,2-oxazole-5-carbonyl chloride SMILES: ClC(=O)C1=CC=NO1

Poids moléculaire (g/mol) 131.52
Synonyme isoxazole-5-carbonyl chloride,5-isoxazolecarbonyl chloride,isoxazole-5-carbonylchloride,isoxazole-5-carboxylic acid chloride,acmc-1bhwq,5-isoxazolecarbonylchloride,isoxazol-5-carbonyl chloride,isoxazole-5-carbonyl-chloride,5-isoxazolecarbonyl chloride 9ci
Numéro MDL MFCD00067868
CAS 62348-13-4
CID PubChem 2736707
Nom IUPAC 1,2-oxazole-5-carbonyl chloride
Clé InChI NASLINFISOTVJJ-UHFFFAOYSA-N
SMILES ClC(=O)C1=CC=NO1
Formule moléculaire C4H2ClNO2