Organoheterocyclic compounds
2,4,5-Trimethylthiazole, 98%
CAS: 13623-11-5 Molecular Formula: C6H9NS Molecular Weight (g/mol): 127.205 MDL Number: MFCD00005332 InChI Key: BAMPVSWRQZNDQC-UHFFFAOYSA-N Synonym: 2,4,5-trimethylthiazole,trimethylthiazole,trimethyl thiazole,thiazole, trimethyl,thiazole, 2,4,5-trimethyl,trimethyl-1,3-thiazole,2,4,5-trimethyl thiazole,thiazole, 2,4,5-trimethyl-8ci 9ci,fema no. 3325,trimethyl-thiazole PubChem CID: 61653 ChEBI: CHEBI:78738 IUPAC Name: 2,4,5-trimethyl-1,3-thiazole SMILES: CC1=C(SC(=N1)C)C
s-Trioxane, 99+%
CAS: 110-88-3 Molecular Formula: C3H6O3 Molecular Weight (g/mol): 90.08 MDL Number: MFCD00006563 InChI Key: BGJSXRVXTHVRSN-UHFFFAOYSA-N Synonym: s-trioxane,trioxymethylene,metaformaldehyde,triformol,formaldehyde, trimer,aldeform,formagene,marvosan,trioxan,sym-trioxane PubChem CID: 8081 ChEBI: CHEBI:38043 IUPAC Name: 1,3,5-trioxane SMILES: C1OCOCO1
1,8-Naphthalimide, 98%
CAS: 81-83-4 Molecular Formula: C12H7NO2 Molecular Weight (g/mol): 197.193 MDL Number: MFCD00006920 InChI Key: XJHABGPPCLHLLV-UHFFFAOYSA-N Synonym: 1,8-naphthalimide,naphthalimide,1h-benz de isoquinoline-1,3 2h-dione,1h-benzo de isoquinoline-1,3 2h-dione,1,8-naphthalenedicarboximide,benzo de isoquinoline-1,3-dione,unii-gi0tv19gbn,naphthalene-1,8-dicarboximide,gi0tv19gbn PubChem CID: 66491 IUPAC Name: benzo[de]isoquinoline-1,3-dione SMILES: C1=CC2=C3C(=C1)C(=O)NC(=O)C3=CC=C2
2,2,4-Trimethyl-1,3-dioxolane, 99%
CAS: 1193-11-9 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00090841 InChI Key: ALTFLAPROMVXNX-UHFFFAOYNA-N PubChem CID: 62384 IUPAC Name: 2,2,4-trimethyl-1,3-dioxolane SMILES: CC1COC(C)(C)O1
2-Phenylindole, 95%
CAS: 948-65-2 Molecular Formula: C14H11N Molecular Weight (g/mol): 193.249 MDL Number: MFCD00005608 InChI Key: KLLLJCACIRKBDT-UHFFFAOYSA-N Synonym: 2-phenylindole,1h-indole, 2-phenyl,indole, 2-phenyl,stabilizer i,alpha-phenylindole,2-phenyl indole,phenylindole,unii-mqd44hv3p1,.alpha.-phenylindole,mqd44hv3p1 PubChem CID: 13698 IUPAC Name: 2-phenyl-1H-indole SMILES: C1=CC=C(C=C1)C2=CC3=CC=CC=C3N2
5-Cyanopyridine-2-carboxylic acid, 95%
CAS: 53234-55-2 Molecular Formula: C7H4N2O2 Molecular Weight (g/mol): 148.12 MDL Number: MFCD09152775 InChI Key: HRLVPHGCEGTVLK-UHFFFAOYSA-N Synonym: 5-cyanopicolinic acid,5-cyano-2-pyridinecarboxylic acid,2-pyridinecarboxylic acid, 5-cyano,5-cyano-2-pyridincarboxylic acid,5-cyanopicolinicacid,5-cyano-picolinic acid,pubchem16740,acmc-1cubt,5-cyano-2-picolinic acid,5-cyano-2-pyridine carboxylic acid PubChem CID: 12400734 IUPAC Name: 5-cyanopyridine-2-carboxylic acid SMILES: OC(=O)C1=NC=C(C=C1)C#N
2-Amino-5-bromopyrazine, 97%
CAS: 59489-71-3 Molecular Formula: C4H4BrN3 Molecular Weight (g/mol): 174.001 MDL Number: MFCD00235015 InChI Key: KRRTXVSBTPCDOS-UHFFFAOYSA-N Synonym: 2-amino-5-bromopyrazine,5-bromo-2-pyrazinamine,5-bromo-pyrazin-2-ylamine,2-bromo-5-aminopyrazine,pyrazinamine, 5-bromo,5-amino-2-bromopyrazine,5-bromo-2-aminopyrazine,5-bromopyrazin-2-ylamine,5-bromopyrazinamine,2-amino-5-bromo-pyrazine PubChem CID: 599539 IUPAC Name: 5-bromopyrazin-2-amine SMILES: C1=C(N=CC(=N1)Br)N
1-Methyl-4-(4-piperidinyl)piperazine, 98%
CAS: 53617-36-0 Molecular Formula: C10H21N3 Molecular Weight (g/mol): 183.30 MDL Number: MFCD03274729 InChI Key: MRYYJGQKVGZGSB-UHFFFAOYSA-N Synonym: 1-methyl-4-piperidin-4-yl piperazine,1-methyl-4-4-piperidinyl piperazine,1-methyl-4-piperidin-4-yl-piperazine,piperazine, 1-methyl-4-4-piperidinyl,4-methyl-1-4-piperidyl piperazine,acmc-1b13b,1-methyl-4-4-piperidyl piperazine,1-methyl-4-piperidin-4yl-piperazine,1-methyl-4-4-piperidino piperazine PubChem CID: 795707 SMILES: CN1CCN(CC1)C1CCNCC1
Methyl 3-amino-5,6-dichloropyrazine-2-carboxylate, 97%
CAS: 1458-18-0 Molecular Formula: C6H5Cl2N3O2 Molecular Weight (g/mol): 222.025 MDL Number: MFCD00010431 InChI Key: USYMCUGEGUFUBI-UHFFFAOYSA-N Synonym: methyl 3-amino-5,6-dichloro-2-pyrazinecarboxylate,pyrazinecarboxylic acid, 3-amino-5,6-dichloro-, methyl ester,3-amino-5,6-dichloro-2-pyrazinecarboxylic acid methyl ester,3-amino-5,6-dichloro-pyrazine-2-carboxylic acid methyl ester,acmc-1bujh,dsstox_cid_31434,dsstox_rid_97320,dsstox_gsid_57645,methyl 3-amino-5,6-dichloropyrazinoate,methyl 3-amino-5,6-dichloropyrazinecarboxylate PubChem CID: 73828 IUPAC Name: methyl 3-amino-5,6-dichloropyrazine-2-carboxylate SMILES: COC(=O)C1=C(N=C(C(=N1)Cl)Cl)N
2,6-Difluoropyridine-3-boronic acid, 95%, Thermo Scientific™
CAS: 136466-94-9 Molecular Formula: C5H4BF2NO2 Molecular Weight (g/mol): 158.899 MDL Number: MFCD03788245 InChI Key: LCCZTROJRJFXNV-UHFFFAOYSA-N Synonym: 2,6-difluoropyridine-3-boronic acid,2,6-difluoropyridin-3-yl boronic acid,2,6-difluoro-3-pyridineboronic acid,2,6-difluoropyridin-3-yl-3-boronic acid,2,6-difluoropyridine-3-boronicacid,2,6-difluoropyridin-3-ylboronicacid,2,6-difluoro-3-pyridyl boronic acid,2,6-difluoro-3-pyridylboronic acid,boronic acid, 2,6-difluoro-3-pyridinyl,2,6-difluoro-3-pyridinyl boronic acid PubChem CID: 2762713 IUPAC Name: (2,6-difluoropyridin-3-yl)boronic acid SMILES: B(C1=C(N=C(C=C1)F)F)(O)O
1-n-Butyl-3-methylimidazolium methanesulfonate, 99%
CAS: 342789-81-5 Molecular Formula: C9H18N2O3S Molecular Weight (g/mol): 234.314 MDL Number: MFCD06798173 InChI Key: PUHVBRXUKOGSBC-UHFFFAOYSA-M Synonym: 1-butyl-3-methylimidazolium methanesulfonate,1-butyl-3-methylimidazolium mesylate,acmc-20aowi,c4mim mesylate,basionics™ st 78,dsstox_cid_27888,dsstox_rid_82641,dsstox_gsid_47912,1-butyl-3-methylimidazolium methylsulfonate,1-n-butyl-3-methylimidazolium methanesulfonate PubChem CID: 11492381 IUPAC Name: 1-butyl-3-methylimidazol-3-ium;methanesulfonate SMILES: CCCCN1C=C[N+](=C1)C.CS(=O)(=O)[O-]
2-Ethyl-3,5(6)-dimethylpyrazine, 99%, mixture of isomers
CAS: 13925-07-0 Molecular Formula: C8H12N2 Molecular Weight (g/mol): 136.198 MDL Number: MFCD00047392 InChI Key: JZBCTZLGKSYRSF-UHFFFAOYSA-N Synonym: 3,5-dimethyl-2-ethylpyrazine,pyrazine, 2-ethyl-3,5-dimethyl,2,6-dimethyl-3-ethylpyrazine,3-ethyl-2,6-dimethylpyrazine,2-ethyl-3,5-dimethyl pyrazine,pyrazine, 2,6-dimethyl-3-ethyl,unii-r182ey5l8c,fema no. 3149,2-ethyl-3,5 6-dimethylpyrazine,pyrazine, 3,5-dimethyl-2-ethyl PubChem CID: 26334 IUPAC Name: 2-ethyl-3,5-dimethylpyrazine SMILES: CCC1=NC=C(N=C1C)C
1-n-Butyl-4-methylpyridinium hexafluorophosphate, 99%
CAS: 401788-99-6 Molecular Formula: C10H16F6NP Molecular Weight (g/mol): 295.209 MDL Number: MFCD03095438 InChI Key: XBSZSSGZQFAUPF-UHFFFAOYSA-N Synonym: 1-butyl-4-methylpyridinium hexafluorophosphate,4mbppf6,1-butyl-4-methylpyridin-1-ium hexafluorophosphate,acmc-209jbi,dsstox_cid_29152,dsstox_rid_83371,dsstox_gsid_49296 PubChem CID: 11254899 IUPAC Name: 1-butyl-4-methylpyridin-1-ium;hexafluorophosphate SMILES: CCCC[N+]1=CC=C(C=C1)C.F[P-](F)(F)(F)(F)F
Indole-3-carbonitrile, 98%
CAS: 5457-28-3 Molecular Formula: C9H6N2 Molecular Weight (g/mol): 142.16 MDL Number: MFCD00022717 InChI Key: CHIFTAQVXHNVRW-UHFFFAOYSA-N Synonym: 3-cyanoindole,indole-3-carbonitrile,3-indolecarbonitrile,chembl46724,zlchem 360,3-cyano-1h-indole,pubchem7325,acmc-209lhi,1h-indol-3-yl cyanide PubChem CID: 230282 IUPAC Name: 1H-indole-3-carbonitrile SMILES: N#CC1=CNC2=CC=CC=C12
6-Bromopiperonal, 98%
CAS: 15930-53-7 Molecular Formula: C8H5BrO3 Molecular Weight (g/mol): 229.03 MDL Number: MFCD00022952 InChI Key: CSQUXTSIDQURDV-UHFFFAOYSA-N Synonym: 6-bromopiperonal,6-bromo-benzo 1,3 dioxole-5-carbaldehyde,2-bromo-4,5-methylenedioxybenzaldehyde,piperonal, 6-bromo,6-bromobenzo d 1,3 dioxole-5-carbaldehyde,6-bromo-1,3-benzodioxole-5-carboxaldehyde,6-bromo-2h-1,3-benzodioxole-5-carbaldehyde,1,3-benzodioxole-5-carboxaldehyde, 6-bromo,6-bromobenzo 1,3 dioxole-5-carbaldehyde,benzaldehyde, 2-bromo-4,5-methylenedioxy PubChem CID: 95062 SMILES: BrC1=CC2=C(OCO2)C=C1C=O