Organoheterocyclic compounds
Methyl isonicotinate, 98%
CAS: 9-8-2459 Molecular Formula: C7H7NO2 Molecular Weight (g/mol): 137.14 MDL Number: MFCD00006427 InChI Key: OLXYLDUSSBULGU-UHFFFAOYSA-N Synonym: methyl isonicotinate,isonicotinic acid methyl ester,4-pyridinecarboxylic acid, methyl ester,4-picolinic acid methyl ester,4-methoxycarbonylpyridine,methylisonicotinate,methyl 4-pyridinecarboxylate,4-carbomethoxypyridine,isonicotinic acid, methyl ester,i-nicotinic acid, methyl ester PubChem CID: 227085 IUPAC Name: methyl pyridine-4-carboxylate SMILES: COC(=O)C1=CC=NC=C1
Vitamin B12, MP Biomedicals™
CAS: 68-19-9 Molecular Formula: C63H88CoN14O14P Molecular Weight (g/mol): 1355.39 MDL Number: MFCD00151092 InChI Key: YUWVGNQGDAPKCX-BVWPOUIRNA-L Synonym: vitamin b12 PubChem CID: 129893524 IUPAC Name: (10S,12R,13R,24S,35R,41R)-30,35,40-tris(2-carbamoylethyl)-24,36,41-tris(carbamoylmethyl)-1-cyano-46-hydroxy-12-(hydroxymethyl)-5,6,17,23,28,31,31,36,38,41,42-undecamethyl-15,20-dioxo-11,14,16-trioxa-2λ⁵,9,19,26λ⁵,43,44λ⁵,45λ⁵-heptaaza-15λ⁵-phospha-1-cobaltadodecacyclo[27.14.1.1¹,³⁴.1²,⁹.1¹⁰,¹³.0¹,²⁶.0³,⁸.0²³,²⁷.0²⁵,⁴².0³²,⁴⁴.0³⁹,⁴³.0³⁷,⁴⁵]heptatetraconta-2(47),3,5,7,26,28,32(44),33,37(45),38-decaene-1,2,26,44,45-pentakis(ylium)-15-olate SMILES: [C@@H]1(C2=CC3=[N+]4C(C(C3(C)C)CCC(N)=O)=C(C3=[N+]5C6C7(N8C(C([C@@]7(C)CC(N)=O)CCC(N)=O)=C(C(=[N+]2[Co+]458([N+]2=CN(C4=CC(=C(C)C=C24)C)[C@@]2([H])O[C@@H]([C@]([H])(OP([O-])(=O)OC(C)CNC(=O)CCC3(C)[C@@H]6CC(N)=O)C2O)CO)C#N)C1(C)CC(N)=O)C)C)C)CCC(N)=O
1-Chloromethyl-1H-1,2,4-triazole hydrochloride, 96%
CAS: 84387-61-1 Molecular Formula: C3H4ClN3 Molecular Weight (g/mol): 117.54 MDL Number: MFCD00964947 InChI Key: PXNMFQMREJNQQT-UHFFFAOYSA-N PubChem CID: 3743882 SMILES: ClCN1C=NC=N1
2-Bromo-5-pyridinemethanol, 95%
CAS: 122306-01-8 Molecular Formula: C6H6BrNO Molecular Weight (g/mol): 188.024 MDL Number: MFCD04974508 InChI Key: QPPDKOIDAYZUHN-UHFFFAOYSA-N Synonym: 6-bromopyridin-3-yl methanol,2-bromo-5-hydroxymethyl pyridine,6-bromo-pyridin-3-yl-methanol,6-bromo-3-pyridinemethanol,6-bromo-pyridin-3-yl methanol,2-bromo-pyridin-5-yl-methanol,6-bromo-3-pyridyl methanol,2-bromo-5-hydroxymethylpyridine,6-bromo-3-pyridinyl methanol,6-bromopyridine-3-methanol PubChem CID: 6421249 IUPAC Name: (6-bromopyridin-3-yl)methanol SMILES: C1=CC(=NC=C1CO)Br
5-Bromo-2-(trifluoromethyl)pyridine-4-carboxylic acid, 95%, Thermo Scientific Chemicals
CAS: 749875-16-9 Molecular Formula: C7H3BrF3NO2 Molecular Weight (g/mol): 270.01 MDL Number: MFCD10687236 InChI Key: XNVAVQMVAYUTBA-UHFFFAOYSA-N Synonym: 5-bromo-2-trifluoromethyl isonicotinic acid,5-bromo-2-trifluoromethyl pyridine-4-carboxylic acid,5-bromo-2-trifluoromethyl-isonicotinic acid,4-pyridinecarboxylic acid, 5-bromo-2-trifluoromethyl,5-bromo-2-trifluoromethyl isonicotinicacid,3-bromo-6-trifluoromethyl pyridine-4-carboxylic acid PubChem CID: 28306936 IUPAC Name: 5-bromo-2-(trifluoromethyl)pyridine-4-carboxylic acid SMILES: OC(=O)C1=CC(=NC=C1Br)C(F)(F)F
(R)-(+)-3-Aminoquinuclidine dihydrochloride, 98%
CAS: 123536-14-1 Molecular Formula: C7H14N2·2ClH Molecular Weight (g/mol): 199.12 MDL Number: MFCD00191752 InChI Key: STZHBULOYDCZET-KLXURFKVSA-N Synonym: r-3-aminoquinuclidine dihydrochloride,r-+-3-aminoquinuclidine dihydrochloride,r-quinuclidin-3-amine dihydrochloride,3r-1-azabicyclo 2.2.2 octan-3-amine dihydrochloride,3r-quinuclidin-3-amine dihydrochloride,r-+-3-aminoquinuclidine 2hcl,3r-3-aminoquinuclidine dihydrochloride,r-1-aza-bicyclo 2.2.2 oct-3-ylamine dihydrochloride,1-azabicyclo 2.2.2 octan-3-amine, dihydrochloride, 3r,pubchem9967 PubChem CID: 12494972 IUPAC Name: (3R)-1-azabicyclo[2.2.2]octan-3-amine;dihydrochloride SMILES: C1CN2CCC1C(C2)N.Cl.Cl
4,6-Dichloro-2-methylpyrimidine, 97%
CAS: 1780-26-3 Molecular Formula: C5H4Cl2N2 Molecular Weight (g/mol): 163.001 MDL Number: MFCD00090472 InChI Key: FIMUTBLUWQGTIJ-UHFFFAOYSA-N Synonym: 2-methyl-4,6-dichloropyrimidine,4,6-dichloro-2-methyl-pyrimidine,2-mdcp,pyrimidine, 4,6-dichloro-2-methyl,4,6-dichloro-2-methylpyrimidiine,4,6-dichlor-2-methylpyrimidin,4,6-dichloro-2-methyl pyrimidine,pubchem7075,acmc-1bpg6,ksc490s3h PubChem CID: 234997 IUPAC Name: 4,6-dichloro-2-methylpyrimidine SMILES: CC1=NC(=CC(=N1)Cl)Cl
3-(4,5-Dimethyl-2-thazolyl)-2,5-diphenyl-2H-tetrazolium bromide, 99.10%, MP Biomedicals™
CAS: 298-93-1 Molecular Formula: C18H16BrN5S Molecular Weight (g/mol): 414.33 MDL Number: MFCD00011964,MFCD00066662 InChI Key: AZKSAVLVSZKNRD-UHFFFAOYSA-M Synonym: thiazolyl blue,thiazolyl blue tetrazolium bromide,mmt tetrazolium,methylthiazoletetrazolium,mtt,thiazolyl blue monotetrazolium,thiazole blue,3-4,5-dimethylthiazol-2-yl-2,5-diphenyltetrazolium bromide,mtt van,unii-euy85h477i PubChem CID: 64965 ChEBI: CHEBI:53233 IUPAC Name: 2-(4,5-dimethyl-1,3-thiazol-2-yl)-3,5-diphenyl-3H-1,2λ⁵,3,4-tetrazol-2-ylium bromide SMILES: [Br-].CC1=C(C)N=C(S1)[N+]1=NC(=NN1C1=CC=CC=C1)C1=CC=CC=C1
2,3,5-Trifluoropyridine-4-carboxylic acid, 97%, Thermo Scientific Chemicals
CAS: 675602-91-2 Molecular Formula: C6H2F3NO2 Molecular Weight (g/mol): 177.082 MDL Number: MFCD03840205 InChI Key: UKLNELOJJKZMLJ-UHFFFAOYSA-N Synonym: 2,3,5-trifluoroisonicotinic acid,4-pyridinecarboxylic acid, 2,3,5-trifluoro,2,3,5-trifluoropyridine-4-carboxylic acid PubChem CID: 2782836 IUPAC Name: 2,3,5-trifluoropyridine-4-carboxylic acid SMILES: C1=C(C(=C(C(=N1)F)F)C(=O)O)F
N-Hydroxysulfosuccinimide sodium salt, 97%
CAS: 106627-54-7 Molecular Formula: C4H4NNaO6S Molecular Weight (g/mol): 217.127 MDL Number: MFCD00043100 InChI Key: RPENMORRBUTCPR-UHFFFAOYSA-M Synonym: n-hydroxysulfosuccinimide sodium salt,sulfo-nhs,sodium 1-hydroxy-2,5-dioxopyrrolidine-3-sulfonate,n-hydroxysulfosuccinimidesodiumsalt,3-pyrrolidinesulfonic acid, 1-hydroxy-2,5-dioxo-, monosodium salt,sodium 1-hydroxy-2,5-dioxo-pyrrolidine-3-sulfonate,n-hydroxusulfosuccinimide sodium,n-hydroxy-2-sodiosulfo succinimide,n-hydroxysulfosuccinimide,sodium salt,n-hydroxusulfosuccinimide sodium salt PubChem CID: 3520574 IUPAC Name: sodium;1-hydroxy-2,5-dioxopyrrolidine-3-sulfonate SMILES: C1C(C(=O)N(C1=O)O)S(=O)(=O)[O-].[Na+]
2,4-Dimethylpyrrole, 97%
CAS: 625-82-1 Molecular Formula: C6H9N Molecular Weight (g/mol): 95.15 MDL Number: MFCD00192088 InChI Key: MFFMQGGZCLEMCI-UHFFFAOYSA-N Synonym: 2,4-dimethylpyrrole,1h-pyrrole, 2,4-dimethyl,pyrrole, 2,4-dimethyl,unii-ynq49m599x,pubchem24003,2,4-dimethyl-1h-pyrrol,acmc-209n5e,ksc493o6j,# PubChem CID: 39539 IUPAC Name: 2,4-dimethyl-1H-pyrrole SMILES: CC1=CC(C)=CN1
6-Amino-3-chloro-1H-indazole, 97%
CAS: 21413-23-0 Molecular Formula: C7H6ClN3 Molecular Weight (g/mol): 167.60 MDL Number: MFCD07781648 InChI Key: DRRARKIFTNKQDW-UHFFFAOYSA-N Synonym: 3-chloro-1h-indazol-6-amine,6-amino-3-chloro-1h-indazole,1h-indazol-6-amine,3-chloro,6-amino-3-chloroindazole,3-chloro-1h-indazole-6-ylamine,3-chloro-1h-indazol-6-ylamine,6-amino-3-chloro 1h indazole,pubchem23042,3-chloro-indazol-6-amine PubChem CID: 14790453 IUPAC Name: 3-chloro-2H-indazol-6-amine SMILES: NC1=CC2=NNC(Cl)=C2C=C1
1-Benzyl-4-cyano-4-hydroxypiperidine, 98%, Thermo Scientific™
CAS: 6094-60-6 Molecular Formula: C13H16N2O Molecular Weight (g/mol): 216.28 MDL Number: MFCD00023752 InChI Key: XQRLXUYZKZXSBN-UHFFFAOYSA-N Synonym: 1-benzyl-4-cyano-4-hydroxypiperidine,maybridge1_006722,acmc-20aoxx,1-benzyl-4-hydroxyisonipecotonitrile,4-hydroxy-1-benzylpiperidine-4-carbonitrile,1-benyl-4-hydroxy-piperidine-4-carbonitrile,1-benzyl-4-hydroxy-4-piperidinecarbonitrile,1-benzyl-4-hydroxy-piperidine-4-carbonitrile,4-hydroxy-1-phenylmethyl-4-piperidinecarbonitrile PubChem CID: 80189 IUPAC Name: 1-benzyl-4-hydroxypiperidine-4-carbonitrile SMILES: OC1(CCN(CC2=CC=CC=C2)CC1)C#N
6-(Trifluoromethyl)nicotinic acid, 97%
CAS: 231291-22-8 Molecular Formula: C7H3F3NO2 Molecular Weight (g/mol): 190.10 MDL Number: MFCD00792430 InChI Key: JNYLMODTPLSLIF-UHFFFAOYSA-M Synonym: 6-trifluoromethyl nicotinic acid,6-trifluoromethyl pyridine-3-carboxylic acid,6-trifluoromethylnicotinic acid,6-trifluoromethyl-nicotinic acid,2-trifluoromethyl-5-pyridinecarboxylic acid,3-pyridinecarboxylic acid, 6-trifluoromethyl,2-trifluoromethyl pyridine-5-carboxylic acid,6-trifluoromethyl-3-pyridinecarboxylic acid PubChem CID: 2777551 IUPAC Name: 6-(trifluoromethyl)pyridine-3-carboxylic acid SMILES: [O-]C(=O)C1=CC=C(N=C1)C(F)(F)F
2,3,6-Trifluoro-4-(trifluoromethyl)pyridine, 97%, Thermo Scientific Chemicals
CAS: 84940-46-5 Molecular Formula: C6HF6N Molecular Weight (g/mol): 201.071 MDL Number: MFCD03840203 InChI Key: DODFHNWFNCGXOW-UHFFFAOYSA-N Synonym: 2,3,6-trifluoro-4-trifluoromethyl pyridine,pyridine,2,3,6-trifluoro-4-trifluoromethyl,2,3,6-tris fluoranyl-4-trifluoromethyl pyridine PubChem CID: 2782842 IUPAC Name: 2,3,6-trifluoro-4-(trifluoromethyl)pyridine SMILES: C1=C(C(=C(N=C1F)F)F)C(F)(F)F