Organoheterocyclic compounds
Pyrimidine-5-carboxylic acid, 95%
CAS: 4595-61-3 Molecular Formula: C5H4N2O2 Molecular Weight (g/mol): 124.10 MDL Number: MFCD00856162 InChI Key: IIVUJUOJERNGQX-UHFFFAOYSA-N Synonym: 5-pyrimidinecarboxylic acid,5-carboxypyrimidine,pyrimidine-5-carboxilic acid,5-pyrimidine carboxylic acid,pyrimidine-5-carboxylate acid,pyrimidine-5-carboxylicacid,pubchem2056,acmc-209k5a,5-pyrimidyl carboxylic acid,pyrimidin-5-carboxylic acid PubChem CID: 78346 IUPAC Name: pyrimidine-5-carboxylic acid SMILES: OC(=O)C1=CN=CN=C1
6-Bromo-7-fluoro-2,4-dihydro-1,4-benzoxazin-3-one, 96%, Thermo Scientific Chemicals
CAS: 355423-58-4 Molecular Formula: C8H5BrFNO2 Molecular Weight (g/mol): 246.04 MDL Number: MFCD20441932 InChI Key: AVHJMSMGASUDIT-UHFFFAOYSA-N Synonym: 6-bromo-7-fluoro-2,4-dihydro-1,4-benzoxazin-3-one,6-bromo-7-fluoro-2h-benzo b 1,4 oxazin-3 4h-one,2h-1,4-benzoxazin-3 4h-one, 6-bromo-7-fluoro,acmc-209ihm,6-bromo-7-fluoro-4h-benzo 1,4 oxazin-3-one,6-bromo-7-fluoro-2h-1,4-benzoxazin-3 4h-one,6-bromo-7-fluoro-3,4-dihydro-2h-1,4-benzoxazin-3-one PubChem CID: 23574320 IUPAC Name: 6-bromo-7-fluoro-4H-1,4-benzoxazin-3-one SMILES: FC1=C(Br)C=C2NC(=O)COC2=C1
Naphthalene-2-boronic acid pinacol ester, 97%
CAS: 256652-04-7 Molecular Formula: C16H19BO2 Molecular Weight (g/mol): 254.136 MDL Number: MFCD05663868 InChI Key: SPPZBAGKKBHZRW-UHFFFAOYSA-N Synonym: 4,4,5,5-tetramethyl-2-naphthalen-2-yl-1,3,2-dioxaborolane,naphthalene-2-boronic acid pinacol ester,naphthalene-2-boronic acid, pinacol ester,2-naphthaleneboronic acid, pinacol ester,2-naphth-2-yl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,4,4,5,5-tetramethyl-2-2-naphthyl-1,3,2-dioxaborolane,1,3,2-dioxaborolane, 4,4,5,5-tetramethyl-2-2-naphthalenyl,2-naphthaleneboronic acid pinacol ester,4,4,5,5-tetramethyl-2-2-naphthalenyl-1,3,2-dioxaborolane,amtb668 PubChem CID: 10753409 IUPAC Name: 4,4,5,5-tetramethyl-2-naphthalen-2-yl-1,3,2-dioxaborolane SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC3=CC=CC=C3C=C2
5-bromo-1,2-benzisoxazol-3-ylamine, 97%, Thermo Scientific™
CAS: 455280-00-9 Molecular Formula: C7H5BrN2O Molecular Weight (g/mol): 213.03 MDL Number: MFCD09834823 InChI Key: BGMYWBQEKIMHGU-UHFFFAOYSA-N Synonym: 5-bromobenzo d isoxazol-3-ylamine,5-bromobenzo d isoxazol-3-amine,5-bromo-1,2-benzisoxazol-3-ylamine,1,2-benzisoxazol-3-amine, 5-bromo,3-amino-5-bromobenzo d isoxazole,5-bromobenzo d isoxazole-3-ylamine,5-bromanyl-1,2-benzoxazol-3-amine,1,2-benzisoxazol-3-amine,5-bromo PubChem CID: 33589610 IUPAC Name: 5-bromo-1,2-benzoxazol-3-amine SMILES: NC1=NOC2=CC=C(Br)C=C12
4-Amino-2,5-difluorobenzeneboronic acid pinacol ester, 96%
CAS: 939807-75-7 Molecular Formula: C12H16BF2NO2 Molecular Weight (g/mol): 255.072 MDL Number: MFCD09743045 InChI Key: SOHBHFWRCLJGDV-UHFFFAOYSA-N Synonym: 4-amino-2,5-difluorobenzeneboronic acid pinacol ester,2,5-difluoro-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl aniline,2,5-difluoro-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenylamine,4-amino-2,5-difluorophenylboronic acid pinacol ester,2,5-difluoro-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-aniline,2,5-difluoro-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-benzenamine,benzenamine, 2,5-difluoro-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl PubChem CID: 57955144 IUPAC Name: 2,5-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(C=C2F)N)F
N-(2-Hydroxyethyl)piperazine, 98.5%
CAS: 103-76-4 Molecular Formula: C6H14N2O Molecular Weight (g/mol): 130.19 MDL Number: MFCD00005970 InChI Key: WFCSWCVEJLETKA-UHFFFAOYSA-N Synonym: n-2-hydroxyethyl piperazine,1-piperazineethanol,1-2-hydroxyethyl piperazine,hydroxyethylpiperazine,2-1-piperazinyl ethanol,2-hydroxyethylpiperazine,2-piperazinoethanol,2-piperazin-1-yl ethan-1-ol,1-piperazinethanol,4-2-hydroxyethyl piperazine PubChem CID: 7677 IUPAC Name: 2-piperazin-1-ylethanol SMILES: C1CN(CCN1)CCO
Indole-3-carbinol, 97%
CAS: 700-06-1 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.18 MDL Number: MFCD00005632 InChI Key: IVYPNXXAYMYVSP-UHFFFAOYSA-N Synonym: indole-3-carbinol,3-indolemethanol,1h-indol-3-yl methanol,indole-3-methanol,1h-indole-3-methanol,3-hydroxymethylindole,3-indolylcarbinol,indinol,3-indole methanol,indole 3 carbinol PubChem CID: 3712 ChEBI: CHEBI:24814 IUPAC Name: 1H-indol-3-ylmethanol SMILES: C1=CC=C2C(=C1)C(=CN2)CO
2,3-O-Isopropylidene-D-glyceraldehyde, 50% w/w in dichloromethane
CAS: 15186-48-8 Molecular Formula: C6H10O3 Molecular Weight (g/mol): 130.143 MDL Number: MFCD00269682 InChI Key: YSGPYVWACGYQDJ-YFKPBYRVSA-N Synonym: r-+-2,2-dimethyl-1,3-dioxolane-4-carboxaldehyde,4r-2,2-dimethyl-1,3-dioxolane-4-carbaldehyde,r-2,2-dimethyl-1,3-dioxolane-4-carbaldehyde,r-+-glyceraldehyde acetonide,1,3-dioxolane-4-carboxaldehyde, 2,2-dimethyl-, r,acetone d-glyceraldehyde,+-2,2-dimethyl-1,3-dioxolane-4-carboxaldehyde,1,3-dioxolane-4-carboxaldehyde, 2,2-dimethyl-, 4r,4r-2,2-dimethyl-1,3-dioxolan-4-carbaldehyd,pubchem5767 PubChem CID: 259712 IUPAC Name: (4R)-2,2-dimethyl-1,3-dioxolane-4-carbaldehyde SMILES: CC1(OCC(O1)C=O)C
CGS 12066B dimaleate, 98+%, Thermo Scientific Chemicals
CAS: 109028-10-6 Molecular Formula: C25H25F3N4O8 Molecular Weight (g/mol): 566.49 MDL Number: MFCD00055048 InChI Key: HTEVMLYDEWVIQE-LVEZLNDCSA-N Synonym: cgs 12066b dimaleate,1-methyl-4-7-trifluoromethyl pyrrolo 1,2-a quinoxalin-4-yl piperazine; bis butenedioic acid PubChem CID: 71299720 IUPAC Name: (E)-but-2-enedioic acid;4-(4-methylpiperazin-1-yl)-7-(trifluoromethyl)pyrrolo[1,2-a]quinoxaline SMILES: CN1CCN(CC1)C2=NC3=C(C=CC(=C3)C(F)(F)F)N4C2=CC=C4.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O
5-Aminopyrazine-2-carboxylic acid, 95%
CAS: 40155-43-9 Molecular Formula: C5H5N3O2 Molecular Weight (g/mol): 139.114 MDL Number: MFCD07371664 InChI Key: FMEFOOOBIHQRMK-UHFFFAOYSA-N Synonym: 5-amino-2-pyrazinecarboxylic acid,2-amino-5-pyrazinecarboxylic acid,pyrazinecarboxylic acid, 5-amino,5-amino-pyrazine-2-carboxylic acid,5-aminopyrazine-2-carboxylicacid,5-amino-pyrazine-2-carboxylicacid,pubchem7866,5-amino-pyrazinecarboxylic acid,2-amino-5-pirazinecarboxylic acid PubChem CID: 21897334 IUPAC Name: 5-aminopyrazine-2-carboxylic acid SMILES: C1=C(N=CC(=N1)N)C(=O)O
Methyl 5-bromopyrazine-2-carboxylate, 97%, Thermo Scientific Chemicals
CAS: 210037-58-4 Molecular Formula: C6H5BrN2O2 Molecular Weight (g/mol): 217.02 MDL Number: MFCD09991715 InChI Key: PVTAJWAGBTWOPG-UHFFFAOYSA-N Synonym: 5-bromo-pyrazine-2-carboxylic acid methyl ester,pyrazinecarboxylic acid, 5-bromo-, methyl ester,5-bromo-2-pyrazinecarboxylic acid methyl ester,methyl5-bromopyrazine-2-carboxylate,ksc545m4b,5-bromopyrazinecarboxylic acid methyl ester,pyrazinecarboxylicacid,5-bromo-,methylester,methyl 2-bromo-5-pyrazine-carboxylate,2-pyrazinecarboxylic acid, 5-bromo-, methyl ester,2-pyrazinecarboxylicacid, 5-bromo-, methyl ester PubChem CID: 27282430 IUPAC Name: methyl 5-bromopyrazine-2-carboxylate SMILES: COC(=O)C1=CN=C(Br)C=N1
16-Hexadecanolide, 97%
CAS: 109-29-5 Molecular Formula: C16H30O2 Molecular Weight (g/mol): 254.41 MDL Number: MFCD00039668 InChI Key: LOKPJYNMYCVCRM-UHFFFAOYSA-N Synonym: 16-hexadecanolide,hexadecanolide,cyclohexadecanolide,16-hexadecanolactone,1,16-hexadecanolide,dihydroambrettolide,juniperic acid lactone,1,16-hexadecanolactone,hexadecanolactone,16-hydroxyhexadecanoic acid lactone PubChem CID: 7984 SMILES: O=C1CCCCCCCCCCCCCCCO1
5-Hydroxyindole-3-acetic acid, 98%
CAS: 54-16-0 Molecular Formula: C10H9NO3 Molecular Weight (g/mol): 191.186 MDL Number: MFCD00005639 InChI Key: DUUGKQCEGZLZNO-UHFFFAOYSA-N Synonym: 5-hydroxyindole-3-acetic acid,5-hiaa,2-5-hydroxy-1h-indol-3-yl acetic acid,5-hydroxyindoleacetic acid,5-hydroxyheteroauxin,5-hydroxy-1h-indol-3-yl acetic acid,5-oxyindoleacetic acid,hydroxyindoleacetic acid,5-hydroxy-iaa,5-hydroxyindol-3-ylacetic acid PubChem CID: 1826 ChEBI: CHEBI:27823 IUPAC Name: 2-(5-hydroxy-1H-indol-3-yl)acetic acid SMILES: C1=CC2=C(C=C1O)C(=CN2)CC(=O)O
Ethyl 5-chloropyrazine-2-carboxylate, 95%, Thermo Scientific Chemicals
CAS: 54013-04-6 Molecular Formula: C7H7ClN2O2 Molecular Weight (g/mol): 186.60 MDL Number: MFCD18070850 InChI Key: CFKGDFQQELWOHA-UHFFFAOYSA-N Synonym: ethyl 5-chloropyrazinoate,pyrazinecarboxylic acid, 5-chloro-, ethyl ester,ethyl 5-chloro-2-pyrazinecarboxylate,ethyl5-chloropyrazine-2-carboxylate,5-chloro-2-pyrazinecarboxylic acid ethyl ester PubChem CID: 465025 IUPAC Name: ethyl 5-chloropyrazine-2-carboxylate SMILES: CCOC(=O)C1=CN=C(Cl)C=N1
2-Oxetanemethanol, 96%
CAS: 61266-70-4 Molecular Formula: C4H8O2 Molecular Weight (g/mol): 88.106 MDL Number: MFCD00142933 InChI Key: PQZJTHGEFIQMCO-UHFFFAOYSA-N Synonym: 2-hydroxymethyloxetane,2-oxetanemethanol,2-oxetanylmethanol,2,4-epoxybutanol,oxetan-2-yl-methanol,oxetane-2-methanol,methyloloxacyclobutan,2-hydrpxymethyloxetane,oxetan-2-yl methanol,rac-2-hydroxymethyloxetane PubChem CID: 12284142 IUPAC Name: oxetan-2-ylmethanol SMILES: C1COC1CO