Organoheterocyclic compounds
3-(1H-1,2,4-triazol-1-ylmethyl)benzoic acid, ≥97%, Thermo Scientific™
CAS: 857284-23-2 Molecular Formula: C10H9N3O2 Molecular Weight (g/mol): 203.20 MDL Number: MFCD07186456 InChI Key: XIJPFLBFQZEFKY-UHFFFAOYSA-N Synonym: 3-1h-1,2,4-triazol-1-ylmethyl benzoic acid,3-1,2,4 triazol-1-ylmethyl-benzoic acid,3-1,2,4-triazol-1-ylmethyl benzoic acid,benzoic acid,3-1h-1,2,4-triazol-1-ylmethyl,3-1,2,4-triazolylmethyl benzoic acid,3-1h-1,2,4-triazol-1-yl methyl benzoic acid,benzoic acid, 3-1h-1,2,4-triazol-1-ylmethyl PubChem CID: 3159713 IUPAC Name: 3-(1,2,4-triazol-1-ylmethyl)benzoic acid SMILES: OC(=O)C1=CC(CN2C=NC=N2)=CC=C1
Hexamethyleneimine, 99%
CAS: 111-49-9 Molecular Formula: C6H13N Molecular Weight (g/mol): 99.17 MDL Number: MFCD00006934 InChI Key: ZSIQJIWKELUFRJ-UHFFFAOYSA-N Synonym: hexamethyleneimine,homopiperidine,hexahydroazepine,hexahydro-1h-azepine,perhydroazepine,1h-azepine, hexahydro,hexamethylenimine,azacycloheptane,azepan,hexamethylene imine PubChem CID: 8119 ChEBI: CHEBI:32616 IUPAC Name: azepane SMILES: C1CCCNCC1
Methyl 3-aminothiophene-4-carboxylate hydrochloride, 97+%
CAS: 39978-14-8 Molecular Formula: C6H7NO2S Molecular Weight (g/mol): 157.19 MDL Number: MFCD00068149 InChI Key: BUFZZXCVOFBHLS-UHFFFAOYSA-N Synonym: methyl 4-aminothiophene-3-carboxylate hydrochloride,methyl 3-aminothiophene-4-carboxylate hydrochloride,3-carbomethoxy-4-aminothiophene hydrochloride,acmc-209zkz,methyl 4-aminothiophene-3-carboxylate, chloride,3-amino-4-methoxycarbonylthiophene hydrochloride,4-amino-3-methoxycarbonylthiophene hydrochloride,methyl3-aminothiophene-4-carboxylatehydrochloride,4-amino-3-methoxycarbonyl thiophene hydrochloride,methyl 4-aminothiophen-3-carboxylate hydrochloride PubChem CID: 2777609 SMILES: COC(=O)C1=CSC=C1N
5-Nitro-2-furaldehyde, 99%
CAS: 698-63-5 Molecular Formula: C5H3NO4 MDL Number: MFCD00003230 InChI Key: SXINBFXPADXIEY-UHFFFAOYSA-N Synonym: 5-nitro-2-furaldehyde,5-nitrofurfural,nitrofurfural,2-furancarboxaldehyde, 5-nitro,5-nitrofurfuraldehyde,5-nitro-2-furfural,2-furaldehyde, 5-nitro,5-nitrofuraldehyde,5-nitro-2-furancarboxaldehyde,furfural, 5-nitro PubChem CID: 12774 ChEBI: CHEBI:34459 IUPAC Name: 5-nitrofuran-2-carbaldehyde
2-n-Heptylfuran, 97%
CAS: 3777-71-7 Molecular Formula: C11H18O Molecular Weight (g/mol): 166.264 MDL Number: MFCD00051820 InChI Key: BHTUFJXTYNLISA-UHFFFAOYSA-N Synonym: 2-n-heptylfuran,furan, 2-heptyl,unii-7w55a39qxm,ccris 6901,fema no. 3401,2-heptyl furan,furan, heptyl PubChem CID: 19603 IUPAC Name: 2-heptylfuran SMILES: CCCCCCCC1=CC=CO1
2-Methyl-1,3-benzoxazol-4-amine, 97%, Thermo Scientific™
CAS: 342897-54-5 Molecular Formula: C8H8N2O Molecular Weight (g/mol): 148.165 InChI Key: OEULNBJKLTXMSN-UHFFFAOYSA-N Synonym: 2-methylbenzo d oxazol-4-amine,4-amino-2-methyl-1,3-benzoxazole,methylbenzoxazolamine,2-methyl-4-benzoxazolamine,2-methylbenzoxazol-4-amine,2-methyl-4-aminobenzoxazole,2-methylbenzoxazole-4-amine,4-amino-2-methylbenzoxazole,2-methylbenzoxazole-4-ylamine,4-benzoxazolamine, 2-methyl PubChem CID: 10606897 IUPAC Name: 2-methyl-1,3-benzoxazol-4-amine SMILES: CC1=NC2=C(C=CC=C2O1)N
N-Methylpyrrolidone, ACS Reagent, for organic synthesis, prep-LC, and general laboratory use, >99.0%, Solstice
CAS: 872-50-4 Molecular Formula: C5H9NO Molecular Weight (g/mol): 99.133 InChI Key: SECXISVLQFMRJM-UHFFFAOYSA-N Synonym: 1-methyl-2-pyrrolidinone,n-methyl-2-pyrrolidone,n-methylpyrrolidone,1-methyl-2-pyrrolidone,methylpyrrolidone,m-pyrol,n-methyl-2-pyrrolidinone,n-methylpyrrolidinone,1-methylpyrrolidinone,2-pyrrolidinone, 1-methyl PubChem CID: 13387 ChEBI: CHEBI:7307 IUPAC Name: 1-methylpyrrolidin-2-one SMILES: CN1CCCC1=O
gamma-Valerolactone, 98%
CAS: 108-29-2 Molecular Formula: C5H8O2 Molecular Weight (g/mol): 100.117 MDL Number: MFCD00005400 InChI Key: GAEKPEKOJKCEMS-UHFFFAOYSA-N Synonym: gamma-valerolactone,4-valerolactone,4-pentanolide,5-methyldihydrofuran-2 3h-one,4-hydroxypentanoic acid lactone,gamma-pentalactone,4-hydroxyvaleric acid lactone,2 3h-furanone, dihydro-5-methyl,4-methyl-gamma-butyrolactone,pentanolide-1,4 PubChem CID: 7921 ChEBI: CHEBI:48569 IUPAC Name: 5-methyloxolan-2-one SMILES: CC1CCC(=O)O1
1,3-Diisopropylimidazolium chloride, 97+%
CAS: 139143-09-2 Molecular Formula: C9H17ClN2 Molecular Weight (g/mol): 188.70 MDL Number: MFCD03840577 InChI Key: DOFXKPAOJLLPII-UHFFFAOYSA-M Synonym: 1,3-diisopropylimidazolium chloride,1,3-di-i-propylimidazolium chloride,1,3-diisopropyl-1h-imidazol-3-ium chloride,1,3-diisopropylimidazol-1-ium chloride,diic,acmc-20ap45,n,n'-isopropyl imidazolium chloride,1h-imidazolium,1,3-bis 1-methylethyl-, chloride 1:1,n,n inverted exclamation marka-isopropyl imidazolium chloride PubChem CID: 11229242 IUPAC Name: 1,3-di(propan-2-yl)imidazol-1-ium;chloride SMILES: [Cl-].CC(C)N1C=C[N+](=C1)C(C)C
p-Dithiane-2,5-diol, 96%
CAS: 40018-26-6 Molecular Formula: C4H8O2S2 Molecular Weight (g/mol): 152.23 InChI Key: YUIOPHXTILULQC-UHFFFAOYSA-N Synonym: p-dithiane-2,5-diol,2,5-dihydroxy-1,4-dithiane,mercaptoacetaldehyde dimer,4-dithiane-2,5-diol,1,4 dithiane-2,5-diol,2,5-dihydroxy-1,4-dithian,p-dthane-2,5-dol,pubchem20480,1,4dithiane-2,5diol,acmc-1anme PubChem CID: 98330 IUPAC Name: 1,4-dithiane-2,5-diol SMILES: C1C(SCC(S1)O)O
2,4,5-Trimethyloxazole, 97%
CAS: 20662-84-4 Molecular Formula: C6H9NO Molecular Weight (g/mol): 111.144 MDL Number: MFCD00005308 InChI Key: ZRLDBDZSLLGDOX-UHFFFAOYSA-N Synonym: 2,4,5-trimethyloxazole,trimethyloxazole,oxazole, trimethyl,unii-b04pf51wxi,2,4,5-trimethyl oxazole,trimethyl-1,3-oxazole,b04pf51wxi,oxazole, 2,4,5-trimethyl,trimethyl-oxazole,pubchem8636 PubChem CID: 30215 IUPAC Name: 2,4,5-trimethyl-1,3-oxazole SMILES: CC1=C(OC(=N1)C)C
Methyl 2-methyl-3-furoate, 97%
CAS: 6141-58-8 Molecular Formula: C7H8O3 Molecular Weight (g/mol): 140.138 MDL Number: MFCD00003249 InChI Key: UVRRIABXNIGUJZ-UHFFFAOYSA-N PubChem CID: 80237 IUPAC Name: methyl 2-methylfuran-3-carboxylate SMILES: CC1=C(C=CO1)C(=O)OC
2-Amino-4-chloropyridine, 97%
CAS: 19798-80-2 Molecular Formula: C5H6ClN2 Molecular Weight (g/mol): 129.57 MDL Number: MFCD04113820 InChI Key: RQMWVVBHJMUJNZ-UHFFFAOYSA-O Synonym: 2-amino-4-chloropyridine,4-chloro-pyridin-2-ylamine,2-pyridinamine, 4-chloro,4-chloro-2-pyridinamine,4-chloro-2-pyridylamine,2-amino-4-chloro pyridine,4-chloro-2-pyridinylamine,2-amino-4-chloro-pyridine,4-chloro-2-aminopyridine,4-chlorpyridin-2-amin PubChem CID: 581866 IUPAC Name: 4-chloropyridin-2-amine SMILES: NC1=CC(Cl)=CC=[NH+]1
7-Azaindole-5-boronic acid pinacol ester, 97%
CAS: 754214-56-7 Molecular Formula: C13H17BN2O2 Molecular Weight (g/mol): 244.10 MDL Number: MFCD08060937 InChI Key: UOXAMYZTYZLSCC-UHFFFAOYSA-N Synonym: 5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrrolo 2,3-b pyridine,7-azaindole-5-boronic acid pinacol ester,5-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-1h-pyrrolo 2,3-b pyridine,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrrolo 2,3-b pyridine,pyrrolo 2,3-b pyridine-5-boronic acid, pinacol ester,pyrrolo 2,3-b pyridin-5-ylboronic acid pinacol ester,zlchem 1246,pubchem16626,acmc-209szp,ksc641k4p PubChem CID: 24208789 IUPAC Name: 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridine SMILES: CC1(C)OB(OC1(C)C)C1=CN=C2NC=CC2=C1
3-Indolemethanol, 97%
CAS: 700-06-1 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.177 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