Organoheterocyclic compounds
4-Cyano-4-phenylpiperidine hydrochloride, 97%
CAS: 51304-58-6 Molecular Formula: C12H15ClN2 Molecular Weight (g/mol): 222.716 MDL Number: MFCD00012775 InChI Key: CQPHZBOPSZGTJM-UHFFFAOYSA-N Synonym: 4-cyano-4-phenylpiperidine hydrochloride,4-phenylpiperidine-4-carbonitrile hydrochloride,4-cyano-4-phenylpiperidinehydrochloride,4-phenylpiperidine-4-carbonitrile, chloride,4-phenylpiperidine-4-carbonitrile hcl,pubchem19077,acmc-20a3zw,4-cyano-4-phenylpiperidine hcl,timtec-bb sbb003334,4-phenylisonipecotonitrile hydrochloride PubChem CID: 3084973 IUPAC Name: 4-phenylpiperidine-4-carbonitrile;hydrochloride SMILES: C1CNCCC1(C#N)C2=CC=CC=C2.Cl
1-(4-Acetylpiperidino)ethan-1-one, 97%, Thermo Scientific™
CAS: 162368-01-6 Molecular Formula: C9H15NO2 Molecular Weight (g/mol): 169.22 MDL Number: MFCD00106774 InChI Key: VFZXZEJGLKOTBW-UHFFFAOYSA-N Synonym: 1-4-acetylpiperidino ethan-1-one,1-1-acetylpiperidin-4-yl ethanone,1,4-diacetylpiperidine,1-4-acetylpiperidin-1-yl ethan-1-one,1,1'-piperidine-1,4-diyl diethanone,1-1-acetyl-piperidin-4-yl-ethanone,piperidine, 1,4-diacetyl-9ci,1-4-acetylpiperidin-1-yl ethanone,ethanone,1-1-acetyl-4-piperidinyl,piperidine, 1,4-diacetyl PubChem CID: 2777250 IUPAC Name: 1-(1-acetylpiperidin-4-yl)ethanone SMILES: CC(=O)C1CCN(CC1)C(C)=O
Hemin, 95%, MP Biomedicals™
CAS: 16009-13-5 Molecular Formula: C34H32ClFeN4O4 Molecular Weight (g/mol): 651.95 MDL Number: MFCD00010726 InChI Key: BTIJJDXEELBZFS-HXFTUNQESA-K Synonym: chlorohemin,hemin chloride,protoferriheme,ferriheme,ferriprotoporphyrin ix chloride,ferriprotoporphyrin ix,panhematin,protohemin,protohemin ix,ferriprotoporphyrin PubChem CID: 131675604 IUPAC Name: 3-[(1Z,6Z,12Z,17Z)-5-(2-carboxyethyl)-22-chloro-15,20-diethenyl-4,10,14,19-tetramethyl-21,23,24,25-tetraaza-22-ferrahexacyclo[9.9.3.1³,⁶.1¹³,¹⁶.0⁸,²³.0¹⁸,²¹]pentacosa-1,3(25),4,6,8,10,12,14,16(24),17,19-undecaen-9-yl]propanoic acid SMILES: CC1=C(CCC(O)=O)\C2=C\C3=C(CCC(O)=O)C(C)=C4\C=C5/N=C(/C=C6\N([Fe](Cl)N34)\C(=C/C1=N2)C(C=C)=C6C)C(C=C)=C5C
4-Pyrimidin-2-ylbenzonitrile, 95%, Thermo Scientific™
CAS: 78322-96-0 Molecular Formula: C11H7N3 Molecular Weight (g/mol): 181.198 MDL Number: MFCD09817491 InChI Key: WGCKVXHOTDDNOA-UHFFFAOYSA-N Synonym: 4-pyrimidin-2-yl benzonitrile,4-cyanophenyl pyrimidine,2-4-cyanophenyl pyrimidine,4-pyrimidin-2-yl-benzonitrile,4-2-pyrimidinyl benzonitrile,benzonitrile, 4-2-pyrimidinyl,4-pyrimidin-2-ylbenzenecarbonitrile PubChem CID: 15486310 IUPAC Name: 4-pyrimidin-2-ylbenzonitrile SMILES: C1=CN=C(N=C1)C2=CC=C(C=C2)C#N
2-n-Pentylfuran, 98%
CAS: 3777-69-3 Molecular Formula: C9H14O Molecular Weight (g/mol): 138.21 MDL Number: MFCD00036497 InChI Key: YVBAUDVGOFCUSG-UHFFFAOYSA-N Synonym: furan, 2-pentyl,2-n-pentylfuran,2-amylfuran,furan, pentyl,pentylfuran,natural,unii-6i0qaj1jzq,2-pentyl furan,fema no. 3317,6i0qaj1jzq PubChem CID: 19602 IUPAC Name: 2-pentylfuran SMILES: CCCCCC1=CC=CO1
3-Furanmethanol, 99%
CAS: 4412-91-3 Molecular Formula: C5H6O2 Molecular Weight (g/mol): 98.10 MDL Number: MFCD00005352 InChI Key: STJIISDMSMJQQK-UHFFFAOYSA-N Synonym: 3-furanmethanol,furan-3-methanol,3-furylmethanol,3-hydroxymethyl furan,3-furfuryl alcohol,3-hydroxymethylfuran,3-furyl alcohol,furan-3-yl-methanol,furan-3-yl methanol,3-hydroxymethyl-furan PubChem CID: 20449 IUPAC Name: furan-3-ylmethanol SMILES: OCC1=COC=C1
Pyrimidine, 98+%
CAS: 289-95-2 Molecular Formula: C4H4N2 Molecular Weight (g/mol): 80.09 MDL Number: MFCD00006059 InChI Key: CZPWVGJYEJSRLH-UHFFFAOYSA-N Synonym: 1,3-diazine,metadiazine,m-diazine,miazine,1,3-diazabenzene,base,1,3-diazin,pyrimidin,unii-k8cxk5q32l,k8cxk5q32l PubChem CID: 9260 ChEBI: CHEBI:16898 IUPAC Name: pyrimidine SMILES: C1=CN=CN=C1
1H-Benzimidazole-2-carboxylic acid hydrate, 90%, Thermo Scientific™
CAS: 849776-47-2 Molecular Formula: C8H8N2O3 Molecular Weight (g/mol): 180.163 InChI Key: YQHUUYLPOCNBKD-UHFFFAOYSA-N Synonym: 1h-benzo d imidazole-2-carboxylic acid hydrate,1h-benzimidazole-2-carboxylic acid hydrate,1h-benzimidazole-2-carboxylic acid monohydrate,benzimidazole-2-carboxylic acid monohydrate,1h-1,3-benzodiazole-2-carboxylic acid hydrate,1h-benzimidazole-2-carboxylicacid, hydrate 1:1,c8h6n2o2.h2o,2-carboxy-1h-benzimidazole hydrate,1h-benzimidazole-2-carboxylic acid-water 1/1 PubChem CID: 18525703 IUPAC Name: 1H-benzimidazole-2-carboxylic acid;hydrate SMILES: C1=CC=C2C(=C1)NC(=N2)C(=O)O.O
3-Thiophenemethanol, 97%
CAS: 71637-34-8 Molecular Formula: C5H6OS Molecular Weight (g/mol): 114.16 MDL Number: MFCD00014534 InChI Key: BOWIFWCBNWWZOG-UHFFFAOYSA-N Synonym: 3-thiophenemethanol,3-thienylmethanol,thiophene-3-methanol,3-thiophene methanol,3-hydroxymethylthiophene,thien-3-ylmethanol,thiophen-3-yl methanol,3-thienylmethan-1-ol,3-hydroxymethyl thiophene,3-thiophenylmethanol PubChem CID: 123570 IUPAC Name: thiophen-3-ylmethanol SMILES: OCC1=CSC=C1
5-Methylbenzimidazole, 98%
CAS: 614-97-1 Molecular Formula: C8H8N2 Molecular Weight (g/mol): 132.166 MDL Number: MFCD00010740 InChI Key: RWXZXCZBMQPOBF-UHFFFAOYSA-N Synonym: 5-methylbenzimidazole,5-methyl-1h-benzo d imidazole,1h-benzimidazole, 5-methyl,5-methyl-1h-benzimidazole,benzimidazole, 5-methyl,ethyl 4-cyanophenylalaninate,1h-benzimidazole, 6-methyl,5-methyl-1h-1,3-benzodiazole,6-methyl-1h-1,3-benzodiazole,5mb PubChem CID: 11979 ChEBI: CHEBI:40205 IUPAC Name: 6-methyl-1H-benzimidazole SMILES: CC1=CC2=C(C=C1)N=CN2
5-Cyanoindole, 99%
CAS: 15861-24-2 Molecular Formula: C9H6N2 Molecular Weight (g/mol): 142.16 MDL Number: MFCD00005669 InChI Key: YHYLDEVWYOFIJK-UHFFFAOYSA-N Synonym: 5-cyanoindole,indole-5-carbonitrile,5-cyano indole,5-cyano-1h-indole,indole-5-cyano,5-indolecarbonitrile,5-cyano-indole,indol-5-carbonitrile,indole, 5-cyano,pubchem7326 PubChem CID: 27513 IUPAC Name: 1H-indole-5-carbonitrile SMILES: C1=CC2=C(C=CN2)C=C1C#N
2-Thiopheneboronic acid, 97%
CAS: 6165-68-0 Molecular Formula: C4H5BO2S Molecular Weight (g/mol): 127.95 MDL Number: MFCD00151850 InChI Key: ARYHTUPFQTUBBG-UHFFFAOYSA-N Synonym: thiophene-2-boronic acid,2-thiopheneboronic acid,2-thienylboronic acid,thienylboronic acid,2-thiopheneboronicacid,thiophen-2-ylboranediol,thiophene2-boronic acid,thiophen-2-yl boronic acid,2-thiophenylboric acid,boronic acid, thienyl PubChem CID: 2733960 IUPAC Name: thiophen-2-ylboronic acid SMILES: OB(O)C1=CC=CS1
2-n-Hexylfuran, 97%
CAS: 3777-70-6 Molecular Formula: C10H16O Molecular Weight (g/mol): 152.237 MDL Number: MFCD00053134 InChI Key: XBLCAKKYMZVLPU-UHFFFAOYSA-N Synonym: 2-n-hexylfuran,furan, 2-hexyl,2-hexyl-furan,acmc-1clja PubChem CID: 77408 IUPAC Name: 2-hexylfuran SMILES: CCCCCCC1=CC=CO1
Isothiazole, 97%, Thermo Scientific Chemicals
CAS: 288-16-4 Molecular Formula: C3H3NS Molecular Weight (g/mol): 85.13 InChI Key: ZLTPDFXIESTBQG-UHFFFAOYSA-N Synonym: isothiazole,2-azathiophene,1,2-thiazol,isothiazole;1,2-thiazole,4-fluoro-3'-methylbenzophenone PubChem CID: 67515 ChEBI: CHEBI:35600 IUPAC Name: 1,2-thiazole SMILES: C1=CSN=C1
3-n-Hexylthiophene, 98%
CAS: 1693-86-3 Molecular Formula: C10H16S Molecular Weight (g/mol): 168.298 MDL Number: MFCD00143181 InChI Key: JEDHEMYZURJGRQ-UHFFFAOYSA-N Synonym: 3-n-hexylthiophene,thiophene, 3-hexyl,3-hexylthiopene,3-hexylthiophen,4-hexylthiophene,hexylthiophene 3-,pubchem8861,poly,3-hexylthiophene,3-hexylthiophene, 97+% PubChem CID: 566849 IUPAC Name: 3-hexylthiophene SMILES: CCCCCCC1=CSC=C1