Organoheterocyclic compounds
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Epichlorohydrin, >99%, MP Biomedicals™
CAS: 106-89-8 Molecular Formula: C3H5ClO Molecular Weight (g/mol): 92.522 InChI Key: BRLQWZUYTZBJKN-UHFFFAOYSA-N Synonym: epichlorohydrin,2-chloromethyl oxirane,epichlorhydrin,1-chloro-2,3-epoxypropane,glycidyl chloride,oxirane, chloromethyl,epichlorhydrine,1,2-epoxy-3-chloropropane,2,3-epoxypropyl chloride,chloropropylene oxide PubChem CID: 7835 ChEBI: CHEBI:37144 IUPAC Name: 2-(chloromethyl)oxirane SMILES: C1C(O1)CCl
| PubChem CID | 7835 |
|---|---|
| CAS | 106-89-8 |
| Molecular Weight (g/mol) | 92.522 |
| ChEBI | CHEBI:37144 |
| SMILES | C1C(O1)CCl |
| Synonym | epichlorohydrin,2-chloromethyl oxirane,epichlorhydrin,1-chloro-2,3-epoxypropane,glycidyl chloride,oxirane, chloromethyl,epichlorhydrine,1,2-epoxy-3-chloropropane,2,3-epoxypropyl chloride,chloropropylene oxide |
| IUPAC Name | 2-(chloromethyl)oxirane |
| InChI Key | BRLQWZUYTZBJKN-UHFFFAOYSA-N |
| Molecular Formula | C3H5ClO |
3-Indolebutyric acid, 98%
CAS: 133-32-4 Molecular Formula: C12H13NO2 Molecular Weight (g/mol): 203.24 MDL Number: MFCD00005664 InChI Key: JTEDVYBZBROSJT-UHFFFAOYSA-N Synonym: indole-3-butyric acid,3-indolebutyric acid,4-1h-indol-3-yl butanoic acid,indolebutyric acid,hormodin,1h-indole-3-butanoic acid,seradix,indole-3-butanoic acid,jiffy grow,4-indol-3-yl butyric acid PubChem CID: 8617 ChEBI: CHEBI:33070 IUPAC Name: 4-(1H-indol-3-yl)butanoic acid SMILES: C1=CC=C2C(=C1)C(=CN2)CCCC(=O)O
| PubChem CID | 8617 |
|---|---|
| CAS | 133-32-4 |
| Molecular Weight (g/mol) | 203.24 |
| ChEBI | CHEBI:33070 |
| MDL Number | MFCD00005664 |
| SMILES | C1=CC=C2C(=C1)C(=CN2)CCCC(=O)O |
| Synonym | indole-3-butyric acid,3-indolebutyric acid,4-1h-indol-3-yl butanoic acid,indolebutyric acid,hormodin,1h-indole-3-butanoic acid,seradix,indole-3-butanoic acid,jiffy grow,4-indol-3-yl butyric acid |
| IUPAC Name | 4-(1H-indol-3-yl)butanoic acid |
| InChI Key | JTEDVYBZBROSJT-UHFFFAOYSA-N |
| Molecular Formula | C12H13NO2 |
2-Bromothiazole-5-carboxylic acid, 97%
CAS: 54045-76-0 Molecular Formula: C4H2BrNO2S Molecular Weight (g/mol): 208.03 MDL Number: MFCD04115730 InChI Key: BESGTWHUMYHYEQ-UHFFFAOYSA-N Synonym: 2-bromothiazole-5-carboxylic acid,2-bromo-5-thiazolecarboxylic acid,2-bromo-5-thiazolecarboxylicacid,2-bromo-thiazole-5-carboxylic acid,2-bromo-5-carboxythiazole,5-thiazolecarboxylic acid, 2-bromo,2-bromthiazol-5-carboxylic acid,pubchem15963,acmc-1ap3n,2-bromothiazole-5-carboxylic PubChem CID: 2763210 IUPAC Name: 2-bromo-1,3-thiazole-5-carboxylic acid SMILES: C1=C(SC(=N1)Br)C(=O)O
| PubChem CID | 2763210 |
|---|---|
| CAS | 54045-76-0 |
| Molecular Weight (g/mol) | 208.03 |
| MDL Number | MFCD04115730 |
| SMILES | C1=C(SC(=N1)Br)C(=O)O |
| Synonym | 2-bromothiazole-5-carboxylic acid,2-bromo-5-thiazolecarboxylic acid,2-bromo-5-thiazolecarboxylicacid,2-bromo-thiazole-5-carboxylic acid,2-bromo-5-carboxythiazole,5-thiazolecarboxylic acid, 2-bromo,2-bromthiazol-5-carboxylic acid,pubchem15963,acmc-1ap3n,2-bromothiazole-5-carboxylic |
| IUPAC Name | 2-bromo-1,3-thiazole-5-carboxylic acid |
| InChI Key | BESGTWHUMYHYEQ-UHFFFAOYSA-N |
| Molecular Formula | C4H2BrNO2S |
Fenbendazole, USP, 98-101%, Spectrum™ Chemical
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CAS: 43210-67-9 Molecular Formula: C15H13N3O2S Molecular Weight (g/mol): 299.35 InChI Key: HDDSHPAODJUKPD-UHFFFAOYSA-N IUPAC Name: methyl N-[6-(phenylsulfanyl)-1H-1,3-benzodiazol-2-yl]carbamate SMILES: COC(=O)NC1=NC2=CC=C(SC3=CC=CC=C3)C=C2N1
| CAS | 43210-67-9 |
|---|---|
| Molecular Weight (g/mol) | 299.35 |
| SMILES | COC(=O)NC1=NC2=CC=C(SC3=CC=CC=C3)C=C2N1 |
| IUPAC Name | methyl N-[6-(phenylsulfanyl)-1H-1,3-benzodiazol-2-yl]carbamate |
| InChI Key | HDDSHPAODJUKPD-UHFFFAOYSA-N |
| Molecular Formula | C15H13N3O2S |
5-(Methylthio)thiophene-2-carboxylic acid, 97%, Thermo Scientific Chemicals
CAS: 20873-58-9 Molecular Formula: C6H6O2S2 Molecular Weight (g/mol): 174.232 MDL Number: MFCD00173742 InChI Key: FWFWUSLBIIIIEN-UHFFFAOYSA-N Synonym: 5-methylthio thiophene-2-carboxylic acid,5-methylsulfanyl thiophene-2-carboxylic acid,2-thiophenecarboxylic acid, 5-methylthio,2-thiophenecarboxylicacid, 5-methylthio,5-methylthiothiophene-2-carboxylic acid,maybridge1_007717,d04ngc,cambridge id 5103856,5-methylmercaptothiophene-2-carboxylic,5-methylthio-2-thiophenecarboxylic acid PubChem CID: 714372 IUPAC Name: 5-methylsulfanylthiophene-2-carboxylic acid SMILES: CSC1=CC=C(S1)C(=O)O
| PubChem CID | 714372 |
|---|---|
| CAS | 20873-58-9 |
| Molecular Weight (g/mol) | 174.232 |
| MDL Number | MFCD00173742 |
| SMILES | CSC1=CC=C(S1)C(=O)O |
| Synonym | 5-methylthio thiophene-2-carboxylic acid,5-methylsulfanyl thiophene-2-carboxylic acid,2-thiophenecarboxylic acid, 5-methylthio,2-thiophenecarboxylicacid, 5-methylthio,5-methylthiothiophene-2-carboxylic acid,maybridge1_007717,d04ngc,cambridge id 5103856,5-methylmercaptothiophene-2-carboxylic,5-methylthio-2-thiophenecarboxylic acid |
| IUPAC Name | 5-methylsulfanylthiophene-2-carboxylic acid |
| InChI Key | FWFWUSLBIIIIEN-UHFFFAOYSA-N |
| Molecular Formula | C6H6O2S2 |
2-Amino-5-fluoro-4-methylpyridine, 95%
CAS: 301222-66-2 Molecular Formula: C6H7FN2 Molecular Weight (g/mol): 126.134 MDL Number: MFCD06659479 InChI Key: RKMOPXJNMQWPLH-UHFFFAOYSA-N Synonym: 2-amino-5-fluoro-4-picoline,2-amino-5-fluoro-4-methylpyridine,5-fluoro-4-methyl-2-pyridinamine,2-amino-4-methyl-5-fluoropyridine,pubchem1256,5-fluoro-4-methyl-pyridin-2-amine,2-pyridinamine,5-fluoro-4-methyl,2-amino-4-methyl-5-fluoro pyridine,e 5-fluoro-4-methyl-2-pyridinamine,2-pyridinamine, 5-fluoro-4-methyl-9ci PubChem CID: 22063670 IUPAC Name: 5-fluoro-4-methylpyridin-2-amine SMILES: CC1=CC(=NC=C1F)N
| PubChem CID | 22063670 |
|---|---|
| CAS | 301222-66-2 |
| Molecular Weight (g/mol) | 126.134 |
| MDL Number | MFCD06659479 |
| SMILES | CC1=CC(=NC=C1F)N |
| Synonym | 2-amino-5-fluoro-4-picoline,2-amino-5-fluoro-4-methylpyridine,5-fluoro-4-methyl-2-pyridinamine,2-amino-4-methyl-5-fluoropyridine,pubchem1256,5-fluoro-4-methyl-pyridin-2-amine,2-pyridinamine,5-fluoro-4-methyl,2-amino-4-methyl-5-fluoro pyridine,e 5-fluoro-4-methyl-2-pyridinamine,2-pyridinamine, 5-fluoro-4-methyl-9ci |
| IUPAC Name | 5-fluoro-4-methylpyridin-2-amine |
| InChI Key | RKMOPXJNMQWPLH-UHFFFAOYSA-N |
| Molecular Formula | C6H7FN2 |
2-Ethyl-2-oxazoline, 99%
CAS: 10431-98-8 Molecular Formula: C5H9NO Molecular Weight (g/mol): 99.13 MDL Number: MFCD00005302 InChI Key: NYEZZYQZRQDLEH-UHFFFAOYSA-N Synonym: 2-ethyl-2-oxazoline,2-ethyloxazoline,2-ethyl-4,5-dihydrooxazole,oxazole, 2-ethyl-4,5-dihydro,2-oxazoline, 2-ethyl,unii-b8cd92t4p5,unii-jm7uh9q3yn,unii-hnx7574gtx,unii-s5dpg6k67i,ethyl oxazoline PubChem CID: 66412 IUPAC Name: 2-ethyl-4,5-dihydro-1,3-oxazole SMILES: CCC1=NCCO1
| PubChem CID | 66412 |
|---|---|
| CAS | 10431-98-8 |
| Molecular Weight (g/mol) | 99.13 |
| MDL Number | MFCD00005302 |
| SMILES | CCC1=NCCO1 |
| Synonym | 2-ethyl-2-oxazoline,2-ethyloxazoline,2-ethyl-4,5-dihydrooxazole,oxazole, 2-ethyl-4,5-dihydro,2-oxazoline, 2-ethyl,unii-b8cd92t4p5,unii-jm7uh9q3yn,unii-hnx7574gtx,unii-s5dpg6k67i,ethyl oxazoline |
| IUPAC Name | 2-ethyl-4,5-dihydro-1,3-oxazole |
| InChI Key | NYEZZYQZRQDLEH-UHFFFAOYSA-N |
| Molecular Formula | C5H9NO |
N-Iodosuccinimide, 97%
CAS: 516-12-1 Molecular Formula: C4H4INO2 Molecular Weight (g/mol): 224.99 MDL Number: MFCD00005512 InChI Key: LQZMLBORDGWNPD-UHFFFAOYSA-N Synonym: n-iodosuccinimide,succiniodimide,n-iodo succinimide,2,5-pyrrolidinedione, 1-iodo,unii-3cos3x3n4p,nis,succinimide, n-iodo,3cos3x3n4p,1-iodo-pyrrolidine-2,5-dione,1-iodoazolidine-2,5-dione PubChem CID: 120273 ChEBI: CHEBI:53204 IUPAC Name: 1-iodopyrrolidine-2,5-dione SMILES: IN1C(=O)CCC1=O
| PubChem CID | 120273 |
|---|---|
| CAS | 516-12-1 |
| Molecular Weight (g/mol) | 224.99 |
| ChEBI | CHEBI:53204 |
| MDL Number | MFCD00005512 |
| SMILES | IN1C(=O)CCC1=O |
| Synonym | n-iodosuccinimide,succiniodimide,n-iodo succinimide,2,5-pyrrolidinedione, 1-iodo,unii-3cos3x3n4p,nis,succinimide, n-iodo,3cos3x3n4p,1-iodo-pyrrolidine-2,5-dione,1-iodoazolidine-2,5-dione |
| IUPAC Name | 1-iodopyrrolidine-2,5-dione |
| InChI Key | LQZMLBORDGWNPD-UHFFFAOYSA-N |
| Molecular Formula | C4H4INO2 |
beta-Naphthoflavone, 98+%
CAS: 6051-87-2 Molecular Formula: C19H12O2 Molecular Weight (g/mol): 272.303 MDL Number: MFCD00004986 InChI Key: OUGIDAPQYNCXRA-UHFFFAOYSA-N Synonym: beta-naphthoflavone,5,6-benzoflavone,beta-nf,3-phenyl-1h-naphtho 2,1-b pyran-1-one,3-phenyl-1h-benzo f chromen-1-one,1h-naphtho 2,1-b pyran-1-one, 3-phenyl,unii-1bt0256y8o,3-phenylbenzo f chromen-1-one,ccris 3262,.beta.-naphthoflavone PubChem CID: 2361 ChEBI: CHEBI:77013 IUPAC Name: 3-phenylbenzo[f]chromen-1-one SMILES: C1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=CC4=CC=CC=C43
| PubChem CID | 2361 |
|---|---|
| CAS | 6051-87-2 |
| Molecular Weight (g/mol) | 272.303 |
| ChEBI | CHEBI:77013 |
| MDL Number | MFCD00004986 |
| SMILES | C1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=CC4=CC=CC=C43 |
| Synonym | beta-naphthoflavone,5,6-benzoflavone,beta-nf,3-phenyl-1h-naphtho 2,1-b pyran-1-one,3-phenyl-1h-benzo f chromen-1-one,1h-naphtho 2,1-b pyran-1-one, 3-phenyl,unii-1bt0256y8o,3-phenylbenzo f chromen-1-one,ccris 3262,.beta.-naphthoflavone |
| IUPAC Name | 3-phenylbenzo[f]chromen-1-one |
| InChI Key | OUGIDAPQYNCXRA-UHFFFAOYSA-N |
| Molecular Formula | C19H12O2 |
5-Bromopicolinic acid, 97%
CAS: 30766-11-1 Molecular Formula: C6H3BrNO2 Molecular Weight (g/mol): 201.00 MDL Number: MFCD00234149 InChI Key: MNNQIBXLAHVDDL-UHFFFAOYSA-M Synonym: 5-bromopicolinic acid,5-bromo-2-pyridinecarboxylic acid,2-pyridinecarboxylic acid, 5-bromo,5-bromo-2-carboxypyridine,5-bromo-pyridine-2-carboxylic acid,5-bromo-2-picolinic acid,5-bromo-2-carboxy pyridine,5-bromo-2-pyridine carboxylic acid,5-bromopyridine-2-carboxylicacid PubChem CID: 608544 SMILES: [O-]C(=O)C1=CC=C(Br)C=N1
| PubChem CID | 608544 |
|---|---|
| CAS | 30766-11-1 |
| Molecular Weight (g/mol) | 201.00 |
| MDL Number | MFCD00234149 |
| SMILES | [O-]C(=O)C1=CC=C(Br)C=N1 |
| Synonym | 5-bromopicolinic acid,5-bromo-2-pyridinecarboxylic acid,2-pyridinecarboxylic acid, 5-bromo,5-bromo-2-carboxypyridine,5-bromo-pyridine-2-carboxylic acid,5-bromo-2-picolinic acid,5-bromo-2-carboxy pyridine,5-bromo-2-pyridine carboxylic acid,5-bromopyridine-2-carboxylicacid |
| InChI Key | MNNQIBXLAHVDDL-UHFFFAOYSA-M |
| Molecular Formula | C6H3BrNO2 |
Methyl 4-(1H-pyrazol-1-ylmethyl)benzoate, 97%, Thermo Scientific™
CAS: 397328-86-8 Molecular Formula: C12H12N2O2 Molecular Weight (g/mol): 216.24 MDL Number: MFCD08435918 InChI Key: VMCQOZFWPDOGLG-UHFFFAOYSA-N Synonym: methyl 4-1h-pyrazol-1-ylmethyl benzoate,methyl 4-pyrazol-1-ylmethyl benzoate,methyl 4-1h-pyrazol-1-yl methyl benzoate,methyl 4-pyrazolylmethyl benzoate,benzoic acid,4-1h-pyrazol-1-ylmethyl-, methyl ester PubChem CID: 23510322 IUPAC Name: methyl 4-(pyrazol-1-ylmethyl)benzoate SMILES: COC(=O)C1=CC=C(C=C1)CN2C=CC=N2
| PubChem CID | 23510322 |
|---|---|
| CAS | 397328-86-8 |
| Molecular Weight (g/mol) | 216.24 |
| MDL Number | MFCD08435918 |
| SMILES | COC(=O)C1=CC=C(C=C1)CN2C=CC=N2 |
| Synonym | methyl 4-1h-pyrazol-1-ylmethyl benzoate,methyl 4-pyrazol-1-ylmethyl benzoate,methyl 4-1h-pyrazol-1-yl methyl benzoate,methyl 4-pyrazolylmethyl benzoate,benzoic acid,4-1h-pyrazol-1-ylmethyl-, methyl ester |
| IUPAC Name | methyl 4-(pyrazol-1-ylmethyl)benzoate |
| InChI Key | VMCQOZFWPDOGLG-UHFFFAOYSA-N |
| Molecular Formula | C12H12N2O2 |
3-(5-Methyl-2-furyl)butyraldehyde, 99%
CAS: 31704-80-0 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.19 MDL Number: MFCD00209519 InChI Key: PFLUFBMKOXFWSD-UHFFFAOYNA-N Synonym: 3-5-methyl-2-furyl butyraldehyde,3-5-methylfuran-2-yl butanal,3-5-methyl-2-furyl butanal,3-5-methyl-2-furanyl butanal,fema no. 3307,beta5-dimethyl-2-furanpropanal,2-furanpropanal, beta5-dimethyl,2-furanpropanal, beta,5-dimethyl,beta5-dimethyl-2-furanpropionaldehyde,2-furanpropanal, .beta.,5-dimethyl PubChem CID: 3578033 IUPAC Name: 3-(5-methylfuran-2-yl)butanal SMILES: CCC(C=O)C1=CC=C(C)O1
| PubChem CID | 3578033 |
|---|---|
| CAS | 31704-80-0 |
| Molecular Weight (g/mol) | 152.19 |
| MDL Number | MFCD00209519 |
| SMILES | CCC(C=O)C1=CC=C(C)O1 |
| Synonym | 3-5-methyl-2-furyl butyraldehyde,3-5-methylfuran-2-yl butanal,3-5-methyl-2-furyl butanal,3-5-methyl-2-furanyl butanal,fema no. 3307,beta5-dimethyl-2-furanpropanal,2-furanpropanal, beta5-dimethyl,2-furanpropanal, beta,5-dimethyl,beta5-dimethyl-2-furanpropionaldehyde,2-furanpropanal, .beta.,5-dimethyl |
| IUPAC Name | 3-(5-methylfuran-2-yl)butanal |
| InChI Key | PFLUFBMKOXFWSD-UHFFFAOYNA-N |
| Molecular Formula | C9H12O2 |
(S)-N-BOC-Piperidine-2-carboxylic acid, 98%
CAS: 26250-84-0 MDL Number: MFCD00151904 InChI Key: JQAOHGMPAAWWQO-QMMMGPOBSA-N Synonym: boc-pip-oh,s-1-boc-piperidine-2-carboxylic acid,s-n-boc-piperidine-2-carboxylic acid,s-1-tert-butoxycarbonyl piperidine-2-carboxylic acid,boc-l-pipecolic acid,boc-l-pip-oh,n-boc-l-pipecolinic acid,l-n-boc-pipecolic acid,2s-1-tert-butoxycarbonyl piperidine-2-carboxylic acid,2s-1-tert-butoxy carbonyl piperidine-2-carboxylic acid PubChem CID: 688617 IUPAC Name: (2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic acid SMILES: CC(C)(C)OC(=O)N1CCCCC1C(=O)O
| PubChem CID | 688617 |
|---|---|
| CAS | 26250-84-0 |
| MDL Number | MFCD00151904 |
| SMILES | CC(C)(C)OC(=O)N1CCCCC1C(=O)O |
| Synonym | boc-pip-oh,s-1-boc-piperidine-2-carboxylic acid,s-n-boc-piperidine-2-carboxylic acid,s-1-tert-butoxycarbonyl piperidine-2-carboxylic acid,boc-l-pipecolic acid,boc-l-pip-oh,n-boc-l-pipecolinic acid,l-n-boc-pipecolic acid,2s-1-tert-butoxycarbonyl piperidine-2-carboxylic acid,2s-1-tert-butoxy carbonyl piperidine-2-carboxylic acid |
| IUPAC Name | (2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic acid |
| InChI Key | JQAOHGMPAAWWQO-QMMMGPOBSA-N |
Naloxone Hydrochloride, Dihydrate, USP, 98-100.5%, Spectrum™ Chemical
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CAS: 51481-60-8
| CAS | 51481-60-8 |
|---|
(S)-2-Aminomethyl-1-Boc-pyrrolidine, 97%
CAS: 119020-01-8 Molecular Formula: C10H20N2O2 Molecular Weight (g/mol): 200.28 MDL Number: MFCD03419257 InChI Key: SOGXYCNKQQJEED-QMMMGPOBSA-N Synonym: s-1-boc-2-aminomethyl pyrrolidine,s-1-n-boc-2-aminomethyl pyrrolidine,s-tert-butyl 2-aminomethyl pyrrolidine-1-carboxylate,tert-butyl 2s-2-aminomethyl pyrrolidine-1-carboxylate,s-2-aminomethyl-1-n-boc-pyrrolidine,s-2-aminomethyl-1-boc-pyrrolidine,tert-butyl s-2-aminomethylpyrrolidine-1-carboxylate,s-2-aminomethyl-1-n-boc-pyyrolidine PubChem CID: 1512533 IUPAC Name: tert-butyl (2S)-2-(aminomethyl)pyrrolidine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CCC[C@H]1CN
| PubChem CID | 1512533 |
|---|---|
| CAS | 119020-01-8 |
| Molecular Weight (g/mol) | 200.28 |
| MDL Number | MFCD03419257 |
| SMILES | CC(C)(C)OC(=O)N1CCC[C@H]1CN |
| Synonym | s-1-boc-2-aminomethyl pyrrolidine,s-1-n-boc-2-aminomethyl pyrrolidine,s-tert-butyl 2-aminomethyl pyrrolidine-1-carboxylate,tert-butyl 2s-2-aminomethyl pyrrolidine-1-carboxylate,s-2-aminomethyl-1-n-boc-pyrrolidine,s-2-aminomethyl-1-boc-pyrrolidine,tert-butyl s-2-aminomethylpyrrolidine-1-carboxylate,s-2-aminomethyl-1-n-boc-pyyrolidine |
| IUPAC Name | tert-butyl (2S)-2-(aminomethyl)pyrrolidine-1-carboxylate |
| InChI Key | SOGXYCNKQQJEED-QMMMGPOBSA-N |
| Molecular Formula | C10H20N2O2 |