Organoheterocyclic compounds
4-(Tetrahydropyran-4-yloxy)aniline, 97%, Thermo Scientific™
CAS: 917483-71-7 Molecular Formula: C11H15NO2 Molecular Weight (g/mol): 193.246 MDL Number: MFCD09064968 InChI Key: CCIFXNITZHWCRR-UHFFFAOYSA-N Synonym: 4-tetrahydropyran-4-yloxy aniline,4-oxan-4-yloxy aniline,4-tetrahydro-2h-pyran-4-yl oxy aniline,4-oxan-4-yl oxy aniline,4-tetrahydropyran-4-yloxy phenylamine,4-tetrahydro-2h-pyran-4-yloxy aniline,4-tetrahydro-pyran-4-yloxy-phenylamine,4-2h-3,4,5,6-tetrahydropyran-4-yloxy phenylamine PubChem CID: 24229526 IUPAC Name: 4-(oxan-4-yloxy)aniline SMILES: C1COCCC1OC2=CC=C(C=C2)N
3-(1H-Imidazol-1-ylmethyl)benzoic acid hydrochloride, Tech., Thermo Scientific™
CAS: 218131-32-9 Molecular Formula: C11H11ClN2O2 Molecular Weight (g/mol): 238.671 MDL Number: MFCD08690248 InChI Key: YTCNDYWVEAFCMT-UHFFFAOYSA-N Synonym: 3-1h-imidazol-1-ylmethyl benzoic acid hydrochloride,3-imidazol-1-ylmethyl-benzoic acid hydrochloride,3-imidazol-1-ylmethyl benzoic acid hydrochloride,3-imidazolylmethyl benzoic acid, chloride,3-1h-imidazol-1-yl methyl benzoic acid hydrochloride,3-1h-imidazol-1-yl methyl benzoic acid-hydrogen chloride 1/1 PubChem CID: 18525763 IUPAC Name: 3-(imidazol-1-ylmethyl)benzoic acid;hydrochloride SMILES: C1=CC(=CC(=C1)CN2C=CN=C2)C(=O)O.Cl
1-Methyl-1H-indole-7-carboxylic acid, 97%, Thermo Scientific™
CAS: 167479-16-5 Molecular Formula: C10H9NO2 Molecular Weight (g/mol): 175.19 MDL Number: MFCD09879957 InChI Key: DWKIPLIDZYRILV-UHFFFAOYSA-N PubChem CID: 18388362 IUPAC Name: 1-methylindole-7-carboxylic acid SMILES: CN1C=CC2=CC=CC(C(O)=O)=C12
Imidazole-4-acetic acid monohydrochloride, 97%
CAS: 3251-69-2 Molecular Formula: C5H7ClN2O2 Molecular Weight (g/mol): 162.57 MDL Number: MFCD00012698 InChI Key: MWHLCFYPFGFBQO-UHFFFAOYSA-N Synonym: 4-imidazoleacetic acid hydrochloride,2-1h-imidazol-5-yl acetic acid hydrochloride,imidazole-4-acetic acid hydrochloride,2-1h-imidazol-4-yl acetic acid hydrochloride,4-imidazoleacetic acid hcl,imidazoleacetic acid hydrochloride,unii-et7a74roao,4-imidazoleaceticacidhydrochloride,i4aa,et7a74roao PubChem CID: 145685 IUPAC Name: 2-(1H-imidazol-5-yl)acetic acid;hydrochloride SMILES: Cl.OC(=O)CC1=CN=CN1
Pyrrole-2-carbonitrile, 97%
CAS: 4513-94-4 Molecular Formula: C5H4N2 Molecular Weight (g/mol): 92.10 MDL Number: MFCD00234061 InChI Key: BQMPGKPTOHKYHS-UHFFFAOYSA-N Synonym: pyrrole-2-carbonitrile,2-cyanopyrrole,unii-6d25bmc1pp,2-carbonitrilepyrrole,6d25bmc1pp,cyanopyrrole,2-cyano-pyrrol,pyrrole carbonitrile,1h-pyrrolecarbonitrile,1h-pyrrol-2-kohlenitrile PubChem CID: 138277 IUPAC Name: 1H-pyrrole-2-carbonitrile SMILES: N#CC1=CC=CN1
3-(1-Pyridinio)-1-propanesulfonate, 99%
CAS: 15471-17-7 Molecular Formula: C8H11NO3S Molecular Weight (g/mol): 201.24 MDL Number: MFCD00064468 InChI Key: REEBJQTUIJTGAL-UHFFFAOYSA-N Synonym: 3-pyridin-1-ium-1-yl propane-1-sulfonate,ndsb-201,1-3-sulphonatopropyl pyridinium,unii-qn4i6ai9ek,3-1-pyridinio-1-propanesulfonate,1-pyridiniumpropane-3-sulfonate,qn4i6ai9ek,1-3-sulfopropyl pyridinium hydroxide, inner salt,pyridinium, 1-3-sulfopropyl-, inner salt,1-3-sulfonatopropyl pyridin-1-ium PubChem CID: 84929 IUPAC Name: 3-pyridin-1-ium-1-ylpropane-1-sulfonate SMILES: [O-]S(=O)(=O)CCC[N+]1=CC=CC=C1
3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)aniline, 97%
CAS: 210907-84-9 Molecular Formula: C12H18BNO2 Molecular Weight (g/mol): 219.09 MDL Number: MFCD03453668 InChI Key: YMXIIVIQLHYKOT-UHFFFAOYSA-N Synonym: 3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl aniline,3-aminophenylboronic acid pinacol ester,benzenamine, 3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl,3-aminophenylboronic acid, pinacol ester,3-tetramethyl-1,3,2-dioxaborolan-2-yl aniline,3-aminobenzeneboronic acid pinacol ester,3-aminophenylboronic acid, pinacol cyclic ester,3-aminophenylboronicacidpinacolester,apbe,amtb060 PubChem CID: 2734655 IUPAC Name: 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline SMILES: CC1(C)OB(OC1(C)C)C1=CC=CC(N)=C1
1-Methyl-3-n-octylimidazolium tetrafluoroborate, 99%
CAS: 244193-52-0 Molecular Formula: C12H23BF4N2 Molecular Weight (g/mol): 282.13 MDL Number: MFCD03095434 InChI Key: GXZCAMSPWNHTAE-UHFFFAOYSA-N Synonym: 1-methyl-3-octylimidazolium tetrafluoroborate,1-methyl-3-n-octylimidazolium tetrafluoroborate,3-methyl-1-octylimidazolium tetrafluoroborate,1-octyl-3-methylimidazolium tetrafluoroborate,omimbf4,dsstox_cid_27919,dsstox_rid_82672,dsstox_gsid_47943,3-methyl-1-octylimidazoliumtetrafluoroborate,1-methyl-3-octylimidazolium tetrafluoroborate hplc PubChem CID: 11460221 SMILES: F[B-](F)(F)F.CCCCCCCCN1C=C[N+](C)=C1
5-Formyl-2-thiopheneboronic acid, 97%
CAS: 4347-33-5 Molecular Formula: C5H5BO3S Molecular Weight (g/mol): 155.96 MDL Number: MFCD02093666 InChI Key: DEQOVKFWRPOPQP-UHFFFAOYSA-N Synonym: 5-formyl-2-thiopheneboronic acid,5-formylthiophen-2-boronic acid,5-formylthiophen-2-yl boronic acid,5-formylthiophene-2-boronic acid,2-formylthiophene-5-boronic acid,5-formylthienyl-2-boronic acid,5-formyl-2-thienyl boronic acid,boronic acid, 5-formyl-2-thienyl,5-formyl-2-thiopheneboronicacid,pubchem1722 PubChem CID: 2773430 IUPAC Name: (5-formylthiophen-2-yl)boronic acid SMILES: OB(O)C1=CC=C(S1)C=O
4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine, 97%
CAS: 181219-01-2 Molecular Formula: C11H16BNO2 Molecular Weight (g/mol): 205.06 MDL Number: MFCD01319051 InChI Key: NLTIETZTDSJANS-UHFFFAOYSA-N Synonym: 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,4-pyridineboronic acid pinacol ester,pyridine-4-boronic acid pinacol ester,4-pyridylboronic acid pinacol ester,pyridine-4-boronic acid, pinacol ester,4-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,pyridine-4-boronic pinacolate,pyridine-4-boronic acid pinacol cyclic ester,2-4-pyridyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,pyridine-4-boronic pinacol ester PubChem CID: 2734648 IUPAC Name: 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine SMILES: CC1(C)OB(OC1(C)C)C1=CC=NC=C1
2-Hydroxyquinoline, 98%
CAS: 59-31-4 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.16 MDL Number: MFCD00006743 InChI Key: LISFMEBWQUVKPJ-UHFFFAOYSA-N Synonym: 2-hydroxyquinoline,2-quinolinol,quinolin-2-ol,carbostyril,2 1h-quinolinone,2-quinolone,quinolin-2 1h-one,quinolinol,quinolinone,alpha-quinolone PubChem CID: 6038 ChEBI: CHEBI:18289 IUPAC Name: 1H-quinolin-2-one SMILES: C1=CC=C2C(=C1)C=CC(=O)N2
5-Carboxyfluorescein, 95%
CAS: 76823-03-5 Molecular Formula: C21H12O7 Molecular Weight (g/mol): 376.32 MDL Number: MFCD00036874 InChI Key: NJYVEMPWNAYQQN-UHFFFAOYSA-N Synonym: 5-carboxyfluorescein,5-fam,4-carboxyfluorescein,4 5-carboxyfluorescein,3',6'-dihydroxy-3-oxo-3h-spiro isobenzofuran-1,9'-xanthene-5-carboxylic acid,3',6'-dihydroxy-3-oxo-3h-spiro 2-benzofuran-1,9'-xanthene-5-carboxylic acid,3',6'-dihydroxy-3-oxospiro 2-benzofuran-1,9'-xanthene-5-carboxylic acid,spiro isobenzofuran-1 3h ,9'-9h xanthene-5-carboxylic acid, 3',6-dihydroxy-3-oxo,bidd:gt0758,5-carboxy fluorescein; 5-fam PubChem CID: 123755 ChEBI: CHEBI:51617 IUPAC Name: 3',6'-dihydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-carboxylic acid SMILES: OC(=O)C1=CC=C2C(=C1)C(=O)OC21C2=CC=C(O)C=C2OC2=CC(O)=CC=C12
1-(2-Chloroethyl)pyrrolidine hydrochloride, 98%
CAS: 7250-67-1 Molecular Formula: C6H13Cl2N Molecular Weight (g/mol): 170.077 MDL Number: MFCD00012718 InChI Key: FSNGFFWICFYWQC-UHFFFAOYSA-N Synonym: 1-2-chloroethyl pyrrolidine hydrochloride,n-2-chloroethyl pyrrolidine hydrochloride,2-chloroethylpyrrolidine hydrochloride,2-pyrrolidinoethyl chloride hydrochloride,pyrrolidine, 1-2-chloroethyl-, hydrochloride,unii-yyq1h343r5,pyrrolidinoethyl chloride, hydrochloride,1-2-chloroethyl pyrrolidine.hcl,1-2-chloroethyl pyrrolidine hcl,2-chloroethylpyrrolidinehydrochloride PubChem CID: 81668 IUPAC Name: 1-(2-chloroethyl)pyrrolidine;hydrochloride SMILES: C1CCN(C1)CCCl.Cl
2-Bromo-5-fluoropyridine, 98%, Thermo Scientific Chemicals
CAS: 41404-58-4 Molecular Formula: C5H3BrFN Molecular Weight (g/mol): 175.98 MDL Number: MFCD00234011 InChI Key: UODINHBLNPPDPD-UHFFFAOYSA-N Synonym: 2-bromo-5-fluoro-pyridine,pyridine, 2-bromo-5-fluoro,pubchem1099,pubchem14324,2-bromo5-fluoropyridine,acmc-1assy,2-bromo-5-fluoropyridin,2-bromo-5-fluorpyridine,2-bromo-5-fluropyridine,5-fluoro-2-bromopyridine PubChem CID: 2783171 IUPAC Name: 2-bromo-5-fluoropyridine SMILES: C1=CC(=NC=C1F)Br
N-Fluoropyridinium trifluoromethanesulfonate, 95%
CAS: 107263-95-6 Molecular Formula: C6H5F4NO3S Molecular Weight (g/mol): 247.164 MDL Number: MFCD00013458 InChI Key: JFZMMCYRTJBQQI-UHFFFAOYSA-M Synonym: 1-fluoropyridinium triflate,n-fluoropyridinium triflate,n-fluoropyridinium trifluoromethanesulfonate,1-fluoropyridinium trifluoromethanesulfonate,1-fluoropyridin-1-ium; trifluoromethanesulfonate,acmc-209shu,ksc182s3j,1-fluoropyridin-1-ium triflate,1-fluoropyridiniumtriflate PubChem CID: 2724576 IUPAC Name: 1-fluoropyridin-1-ium;trifluoromethanesulfonate SMILES: C1=CC=[N+](C=C1)F.C(F)(F)(F)S(=O)(=O)[O-]