Organoheterocyclic compounds
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
3'-Deoxy-2',3'-didehydrothymidine, 98%
CAS: 3056-17-5 Molecular Formula: C10H12N2O4 Molecular Weight (g/mol): 224.22 MDL Number: MFCD00132921 InChI Key: XNKLLVCARDGLGL-HGXVMFPFNA-N Synonym: stavudine,sanilvudine,zerit,2',3'-didehydro-3'-deoxythymidine,estavudina,stavudinum,zerit xr,zerut xr,stavudinum inn-latin,2',3'-anhydrothymidine PubChem CID: 18283 ChEBI: CHEBI:63581 IUPAC Name: 1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-5-methylpyrimidine-2,4-dione SMILES: CC1=CN([C@@H]2O[C@H](CO)C=C2)C(=O)NC1=O
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
2-Anilinopyrimidine-5-carboxylic acid, 97%, Thermo Scientific™
CAS: 450368-25-9 Molecular Formula: C11H9N3O2 Molecular Weight (g/mol): 215.21 MDL Number: MFCD09864415 InChI Key: ZPIYMRAJXNMUPE-UHFFFAOYSA-N Synonym: 2-phenylamino pyrimidine-5-carboxylic acid,5-pyrimidinecarboxylicacid, 2-phenylamino,2-anilino-5-pyrimidinecarboxylic acid,2-anilinopyrimidine-5-carboxylic acid PubChem CID: 23509722 IUPAC Name: 2-anilinopyrimidine-5-carboxylic acid SMILES: OC(=O)C1=CN=C(NC2=CC=CC=C2)N=C1
Guanosine, MP Biomedicals™
CAS: 118-00-3 Molecular Formula: C10H13N5O5 Molecular Weight (g/mol): 283.24 MDL Number: MFCD00010182 InChI Key: NYHBQMYGNKIUIF-UUOKFMHZSA-N Synonym: guanosine,guanine riboside,vernine,guanozin,guanosin,inosine, 2-amino,usaf cb-11,vernine van,l-guanosine,9-beta-d-ribofuranosylguanine PubChem CID: 6802 ChEBI: CHEBI:16750 SMILES: NC1=NC2=C(N=CN2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C(=O)N1
Thermo Scientific Chemicals Isocytosine, 99%
CAS: 108-53-2 Molecular Formula: C4H5N3O Molecular Weight (g/mol): 111.10 MDL Number: MFCD00057557 MFCD00023256 InChI Key: XQCZBXHVTFVIFE-UHFFFAOYSA-N Synonym: isocytosine,2-amino-4-hydroxypyrimidine,2-aminopyrimidin-4-ol,2-aminopyrimidin-4 1h-one,2-amino-4-pyrimdinol,2-amino-4-pyrimidone,2-amino-4-oxypyrimidine,2-aminouracil,4-pyrimidinol, 2-amino,4 1h-pyrimidinone, 2-amino PubChem CID: 66950 ChEBI: CHEBI:55502 IUPAC Name: 2-amino-3,4-dihydropyrimidin-4-one SMILES: NC1=NC=CC(=O)N1
(3-Pyrimidin-5-ylphenyl)methanol, ≥97%, Thermo Scientific™
CAS: 852180-75-7 Molecular Formula: C11H10N2O Molecular Weight (g/mol): 186.21 MDL Number: MFCD06802882 InChI Key: PUCNXFUXTNDXKP-UHFFFAOYSA-N Synonym: 3-pyrimidin-5-ylphenyl methanol,3-pyrimidin-5-yl phenyl methanol,3-5-pyrimidinyl phenyl methanol,benzenemethanol,3-5-pyrimidinyl,3-pyrimidin-5-ylphenyl methan-1-ol PubChem CID: 7162050 SMILES: OCC1=CC=CC(=C1)C1=CN=CN=C1
Pyrimethamine, 100.5%, MP Biomedicals™
CAS: 58-14-0 Molecular Formula: C12H13ClN4 Molecular Weight (g/mol): 248.71 MDL Number: MFCD00057350 InChI Key: WKSAUQYGYAYLPV-UHFFFAOYSA-N Synonym: pyrimethamine,chloridine,daraprim,chloridin,diaminopyritamin,5-4-chlorophenyl-6-ethylpyrimidine-2,4-diamine,ethylpyrimidine,pirimetamina,chloridyn,malocide PubChem CID: 4993 ChEBI: CHEBI:8673 IUPAC Name: 5-(4-chlorophenyl)-6-ethylpyrimidine-2,4-diamine SMILES: CCC1=NC(N)=NC(N)=C1C1=CC=C(Cl)C=C1
Fluorouracil, USP, 98-102%, Spectrum™ Chemical
CAS: 51-21-8 Molecular Formula: C4H3FN2O2 Molecular Weight (g/mol): 130.08 MDL Number: MFCD00006018 InChI Key: GHASVSINZRGABV-UHFFFAOYSA-N IUPAC Name: 5-fluoro-1,2,3,4-tetrahydropyrimidine-2,4-dione SMILES: FC1=CNC(=O)NC1=O
3,5-Dimethylisoxazole-4-carbonyl chloride, Thermo Scientific™
CAS: 31301-45-8 Molecular Formula: C6H6ClNO2 Molecular Weight (g/mol): 159.569 MDL Number: MFCD00052555 InChI Key: MPYGFFPGJMGVSW-UHFFFAOYSA-N Synonym: 3,5-dimethylisoxazole-4-carbonyl chloride,4-isoxazolecarbonyl chloride, 3,5-dimethyl,3,5-dimethylisoxazole-4-carbonylchloride,dimethyl-1,2-oxazole-4-carbonyl chloride,3,5-dimethyl-4-isoxazolecarbonyl chloride,pubchem8669,acmc-20a3wc,3,5-dimethylisoxasole-4-carbonyl chloride,3,5-dimethyisoxazole-4-carbonyl chloride,3,5 dimethylisoxazole-4-carbonyl chloride PubChem CID: 2736265 IUPAC Name: 3,5-dimethyl-1,2-oxazole-4-carbonyl chloride SMILES: CC1=C(C(=NO1)C)C(=O)Cl
3-(Bromomethyl)-5-methylisoxazole, 97%, Thermo Scientific™
CAS: 130628-75-0 Molecular Formula: C5H6BrNO Molecular Weight (g/mol): 176.01 MDL Number: MFCD02677720 InChI Key: ASGJFGPILHALRC-UHFFFAOYSA-N Synonym: 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 PubChem CID: 2776304 IUPAC Name: 3-(bromomethyl)-5-methyl-1,2-oxazole SMILES: CC1=CC(CBr)=NO1
3-Phenylisoxazole-5-carboxylic acid, 97%, Thermo Scientific™
CAS: 14442-12-7 Molecular Formula: C10H7NO3 Molecular Weight (g/mol): 189.17 MDL Number: MFCD01936010 InChI Key: YGTFDJRCCBKLDM-UHFFFAOYSA-N Synonym: 3-phenylisoxazole-5-carboxylic acid,3-phenyl-5-isoxazolecarboxylic acid,5-isoxazolecarboxylic acid, 3-phenyl,3-phenyl-isoxazole-5-carboxylic acid,phenylisoxazolecarboxylicacid,5-carboxy-3-phenylisoxazole,3-phenylisoxazole-5-carboxylic,3-phenyl-5-isoxazolecarboxylicacid,3-phenylisoxazole-5-carboxylicacid,3-phenyl-5-isoxazole carboxylic acid PubChem CID: 737474 IUPAC Name: 3-phenyl-1,2-oxazole-5-carboxylic acid SMILES: C1=CC=C(C=C1)C2=NOC(=C2)C(=O)O
3,4-Dimethylisoxazol-5-amine, 97%, Thermo Scientific™
CAS: 19947-75-2 Molecular Formula: C5H8N2O Molecular Weight (g/mol): 112.132 MDL Number: MFCD00046081 InChI Key: PYNDWPFZDQONDV-UHFFFAOYSA-N Synonym: 5-amino-3,4-dimethylisoxazole,3,4-dimethylisoxazol-5-amine,5-amino-3,4-dimethyl-isoxazole,5-isoxazolamine, 3,4-dimethyl,dimethyl-1,2-oxazol-5-amine,3,4-dimethyl-5-isoxazolamine,5-amino-3,4-dimethyl isoxazole,3,4-dimethylisoxazole-5-ylamine,3,4-dimethylisoxazol-5-ylamine,pubchem8660 PubChem CID: 88317 IUPAC Name: 3,4-dimethyl-1,2-oxazol-5-amine SMILES: CC1=C(ON=C1C)N
5-Methyl-4-isoxazolecarbonyl chloride, 97%, Thermo Scientific™
CAS: 67305-24-2 Molecular Formula: C5H4ClNO2 Molecular Weight (g/mol): 145.542 InChI Key: ZKAQPVQEYCFRTK-UHFFFAOYSA-N Synonym: 5-methyl-4-isoxazolecarbonyl chloride,5-methylisoxazole-4-carbonyl chloride,5-methyl-4-isoxazolecarbonylchloride,4-isoxazolecarbonyl chloride, 5-methyl,4-isoxazolecarbonylchloride, 5-methyl,5-methyl-isoxazole-4-carbonyl chloride,acmc-209nyg,methyl-4-isoxazolecarbonyl chloride,4-isoxazolecarbonylchloride,5-methyl PubChem CID: 2759917 IUPAC Name: 5-methyl-1,2-oxazole-4-carbonyl chloride SMILES: CC1=C(C=NO1)C(=O)Cl
3-(2,6-Dichlorophenyl)-5-methylisoxazole-4-carbonyl chloride, Thermo Scientific™
CAS: 4462-55-9 Molecular Formula: C11H6Cl3NO2 Molecular Weight (g/mol): 290.524 InChI Key: IZQGELJKDARDMZ-UHFFFAOYSA-N Synonym: 3-2,6-dichlorophenyl-5-methylisoxazole-4-carbonyl chloride,dcimc chloride,3-2,6-dichlorophenyl-5-methyl-1,2-oxazole-4-carbonyl chloride,3-2,6-dichlorophenyl-5-methylisoxazole-4-carbonylchloride,4-isoxazolecarbonyl chloride, 3-2,6-dichlorophenyl-5-methyl,3-2,6-dichlorophenyl-5-methylisoxazole-4-carboxylic acid chloride,3-2,6-dichlorophenyl-5-methyl isoxazole-4-carbonyl chloride,pubchem8683,dsstox_cid_31536,dsstox_rid_97421 PubChem CID: 78212 IUPAC Name: 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl chloride SMILES: CC1=C(C(=NO1)C2=C(C=CC=C2Cl)Cl)C(=O)Cl