Organoheterocyclic compounds
3-Bromomethyl-3-oxetanemethanol, 95%
CAS: 22633-44-9 Molecular Formula: C5H9BrO2 Molecular Weight (g/mol): 181.03 MDL Number: MFCD09800598 InChI Key: SESXZSLSTRITGO-UHFFFAOYSA-N PubChem CID: 529264 IUPAC Name: [3-(bromomethyl)oxetan-3-yl]methanol SMILES: OCC1(CBr)COC1
1-Benzyl-3-methylimidazolium chloride, 97%
CAS: 36443-80-8 Molecular Formula: C11H13ClN2 Molecular Weight (g/mol): 208.689 MDL Number: MFCD07784451 InChI Key: FCRZSGZCOGHOGF-UHFFFAOYSA-M Synonym: 1-benzyl-3-methylimidazolium chloride,1-benzyl-3-methyl-1h-imidazol-3-ium chloride,1h-imidazolium,1-methyl-3-phenylmethyl-, chloride 1:1,3-benzyl-1-methylimidazol-1-ium chloride,dsstox_cid_27905,dsstox_rid_82658,dsstox_gsid_47929,ksc576i7l,1-methyl-3-benzylimidazolium chloride,1-benzyl-3-methylimidaz-olium chloride PubChem CID: 10560335 IUPAC Name: 1-benzyl-3-methylimidazol-3-ium;chloride SMILES: C[N+]1=CN(C=C1)CC2=CC=CC=C2.[Cl-]
3-Maleimidopropionic acid, 95%
CAS: 7423-55-4 Molecular Formula: C7H7NO4 Molecular Weight (g/mol): 169.14 MDL Number: MFCD00043030 InChI Key: IUTPJBLLJJNPAJ-UHFFFAOYSA-N Synonym: 3-maleimidopropionic acid,3-2,5-dioxo-2,5-dihydro-1h-pyrrol-1-yl propanoic acid,n-maleoyl-beta-alanine,3-2,5-dioxopyrrol-1-yl propanoic acid,1h-pyrrole-1-propanoic acid, 2,5-dihydro-2,5-dioxo,maleimide-ch2 2-cooh,n-carboxyethylmaleimide,3-maleimdepropionicacid,pubchem11845,acmc-209otw PubChem CID: 573621 IUPAC Name: 3-(2,5-dioxopyrrol-1-yl)propanoic acid SMILES: OC(=O)CCN1C(=O)C=CC1=O
2-Bromo-3-hydroxypyridine, 99%
CAS: 6602-32-0 Molecular Formula: C5H4BrNO Molecular Weight (g/mol): 174.00 MDL Number: MFCD00006220 InChI Key: YKHQFTANTNMYPP-UHFFFAOYSA-N Synonym: 2-bromo-3-hydroxypyridine,2-bromo-3-pyridinol,3-pyridinol, 2-bromo,2-bromo-pyridin-3-ol,3-hydroxy-2-bromopyridine,unii-9dab85h359,2-bromo-3-hydroxy pyridine,2-bromo-3-hydroxy-pyridine,2-bromo-3-hydroxypyridine 2-bromo-3-pyridinol,2-bromo3-pyridinol PubChem CID: 23070 IUPAC Name: 2-bromopyridin-3-ol SMILES: OC1=CC=CN=C1Br
1-Benzylindole-3-carboxylic acid, 95%
CAS: 27018-76-4 Molecular Formula: C16H13NO2 Molecular Weight (g/mol): 251.285 MDL Number: MFCD00057094 InChI Key: LVYDDRHDOKXFMW-UHFFFAOYSA-N Synonym: 1-benzyl-1h-indole-3-carboxylic acid,indole-3-carboxylic acid, 1-benzyl,1h-indole-3-carboxylic acid, 1-phenylmethyl,pubchem7313,cbmicro_033327,cambridge id 5791025,5-22-03-00037 beilstein handbook reference,1-benzylindol-3-carboxylic acid,n-benzylindole-3-carboxylic acid,1h-indole-3-carboxylicacid, 1-phenylmethyl PubChem CID: 33671 IUPAC Name: 1-benzylindole-3-carboxylic acid SMILES: C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)C(=O)O
1-Phenylpiperazine, 98+%
CAS: 92-54-6 Molecular Formula: C10H14N2 Molecular Weight (g/mol): 162.236 MDL Number: MFCD00005957 InChI Key: YZTJYBJCZXZGCT-UHFFFAOYSA-N Synonym: phenylpiperazine,n-phenylpiperazine,piperazine, 1-phenyl,1-phenyl-piperazine,n-phenyldiethylenediamine,1-fenylpiperazin czech,unii-j9225cbi7d,n-phenyl piperazine,1-phenyl piperazine,ccris 4334 PubChem CID: 7096 IUPAC Name: 1-phenylpiperazine SMILES: C1CN(CCN1)C2=CC=CC=C2
4-Nitroimidazole, 97%
CAS: 3034-38-6 Molecular Formula: C3H3N3O2 Molecular Weight (g/mol): 113.08 MDL Number: MFCD00005196 InChI Key: VYDWQPKRHOGLPA-UHFFFAOYSA-N Synonym: 4-nitroimidazole,4-nitro-1h-imidazole,1h-imidazole, 4-nitro,5-nitroimidazole,4 5-nitroimidazole,imidazole, 4-nitro,1h-imidazole, 5-nitro,unii-y8u32az5o7,5 4-nitroimidazole,4-nitro-3h-imidazole PubChem CID: 18208 ChEBI: CHEBI:64635 IUPAC Name: 5-nitro-1H-imidazole SMILES: [O-][N+](=O)C1=CN=CN1
6-Mercaptopurine monohydrate, 98%
CAS: 6112-76-1 Molecular Formula: C5H6N4OS Molecular Weight (g/mol): 170.19 MDL Number: MFCD03854445,MFCD01461928 InChI Key: WFFQYWAAEWLHJC-UHFFFAOYSA-N Synonym: 6-mercaptopurine monohydrate,6-mercaptopurine hydrate,mercaptopurine monohydrate,mercaptopurine hydrate,6h-purine-6-thione, 1,7-dihydro-, monohydrate,6,7-dihydro-3h-purine-6-thione hydrate,purine-6-thiol monohydrate,1,7-dihydro-6h-purine-6-thione monohydrate,purine-6-thiol, monohydrate,unii-e7wed276i5 PubChem CID: 2724350 ChEBI: CHEBI:31822 IUPAC Name: 3,7-dihydropurine-6-thione;hydrate SMILES: O.S=C1N=CNC2=C1NC=N2
2-Amino-5-chloropyridine, 98%
CAS: 1072-98-6 Molecular Formula: C5H5ClN2 Molecular Weight (g/mol): 128.559 MDL Number: MFCD00006324 InChI Key: MAXBVGJEFDMHNV-UHFFFAOYSA-N Synonym: 2-amino-5-chloropyridine,2-pyridinamine, 5-chloro,5-chloro-2-pyridinamine,5-chloro-2-pyridylamine,5-chloro-2-aminopyridine,5-chloro-pyridin-2-ylamine,amino 2--5-chloropyridine,pyridine, 2-amino-5-chloro,2-amino-5-chloro pyridine,2-amino5-chloropyridine PubChem CID: 66174 IUPAC Name: 5-chloropyridin-2-amine SMILES: C1=CC(=NC=C1Cl)N
Isoxazole-5-carboxylic acid, 98%
CAS: 21169-71-1 Molecular Formula: C4H3NO3 Molecular Weight (g/mol): 113.072 MDL Number: MFCD00156151 InChI Key: MIIQJAUWHSUTIT-UHFFFAOYSA-N Synonym: 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 PubChem CID: 2060599 IUPAC Name: 1,2-oxazole-5-carboxylic acid SMILES: C1=C(ON=C1)C(=O)O
2-Aminobenzothiazole, 98%
CAS: 136-95-8 Molecular Formula: C7H6N2S Molecular Weight (g/mol): 150.199 MDL Number: MFCD00005785 InChI Key: UHGULLIUJBCTEF-UHFFFAOYSA-N Synonym: 2-aminobenzothiazole,2-benzothiazolamine,benzo d thiazol-2-amine,benzothiazol-2-ylamine,2-aminobenzthiazole,benzothiazole-2-ylamine,2-iminobenzothiazoline,o-aminobenzothiazole,benzothiazole, 2-amino,2-benzothiazolylamine PubChem CID: 8706 IUPAC Name: 1,3-benzothiazol-2-amine SMILES: C1=CC=C2C(=C1)N=C(S2)N
2,5-Dihydro-2,5-dimethoxyfuran, cis + trans, 99%
CAS: 332-77-4 Molecular Formula: C6H10O3 Molecular Weight (g/mol): 130.14 MDL Number: MFCD00003220 InChI Key: WXFWXFIWDGJRSC-UHFFFAOYNA-N Synonym: 2,5-dihydro-2,5-dimethoxyfuran,furan, 2,5-dihydro-2,5-dimethoxy,2,5-dihydro-2,5-dimethoxyfuran, cis+trans,2,5-dihydro-2,5-dimethoxyfuran, mixture of cis and trans,pubchem6933,ksc490q3d,furan,5-dihydro-2,5-dimethoxy,2,5-dihydro-2,5-dimethoxyfuran,c&t,2,5-dimethoxy-2,5-dihydrofuran,c&t,2,5-dihydro-2,5-dimethoxyfuran, cis + trans PubChem CID: 78974 IUPAC Name: 2,5-dimethoxy-2,5-dihydrofuran SMILES: COC1OC(OC)C=C1
2-Phenylbenzimidazole-5-sulfonic acid monohydrate, 98%
CAS: 27503-81-7 Molecular Formula: C13H10N2O3S Molecular Weight (g/mol): 274.29 MDL Number: MFCD00053007 InChI Key: UVCJGUGAGLDPAA-UHFFFAOYSA-N Synonym: ensulizole,2-phenylbenzimidazole-5-sulfonic acid,phenylbenzimidazole sulfonic acid,2-phenyl-1h-benzo d imidazole-5-sulfonic acid,2-phenyl-1h-benzo d imidazole-6-sulfonic acid,1h-benzimidazole-5-sulfonic acid, 2-phenyl,unii-9yq9di1w42,2-phenyl-1h-benzimidazole-5-sulfonic acid,parsol hs,2-phenyl-5-benzimidazolesulfonic acid PubChem CID: 33919 SMILES: OS(=O)(=O)C1=CC=C2N=C(NC2=C1)C1=CC=CC=C1
6-Chloro-7-deazapurine, 98%
CAS: 3680-69-1 Molecular Formula: C6H4ClN3 Molecular Weight (g/mol): 153.569 MDL Number: MFCD01686865 InChI Key: BPTCCCTWWAUJRK-UHFFFAOYSA-N Synonym: 4-chloro-7h-pyrrolo 2,3-d pyrimidine,4-chloropyrrolo 2,3-d pyrimidine,6-chloro-7-deazapurine,4-chloro-1h-pyrrolo 2,3-d pyrimidine,7h-pyrrolo 2,3-d pyrimidine, 4-chloro,1h-pyrrolo 2,3-d pyrimidine, 4-chloro,6-chloro-7-deazapurine 4-chloro-1h-pyrrolo 2,3-d pyrimidine,4-chloro-1h-pyrrol 2,3-d pyrimidine PubChem CID: 5356682 IUPAC Name: 4-chloro-7H-pyrrolo[2,3-d]pyrimidine SMILES: C1=CNC2=C1C(=NC=N2)Cl
1-Cyclopropyl-4-piperidone, 98%
CAS: 62813-01-8 Molecular Formula: C8H13NO Molecular Weight (g/mol): 139.20 MDL Number: MFCD07374375 InChI Key: DTUJRJIWGWTNFQ-UHFFFAOYSA-N Synonym: 1-cyclopropyl-4-piperidinone,1-cyclopropyl-4-piperidone,4-piperidinone, 1-cyclopropyl,1-cyclopropyl-4-oxopiperidine,4-oxopiperidin-1-yl cyclopropane,1-cyclopropyltetrahydro-4 1h-pyridinone,carbergoline,1-cyclopropyl-4-piperidon,n-cyclopropyl-4-piperidone,acmc-1b4f7 PubChem CID: 16227629 IUPAC Name: 1-cyclopropylpiperidin-4-one SMILES: O=C1CCN(CC1)C1CC1