Organoheterocyclic compounds
Thermo Scientific Chemicals Atorvastatin calcium trihydrate
CAS: 344423-98-9 Molecular Formula: C66H74CaF2N4O13 Molecular Weight (g/mol): 1209.41 InChI Key: SHZPNDRIDUBNMH-NIJVSVLQSA-L IUPAC Name: calcium bis((3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-(propan-2-yl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoate) trihydrate SMILES: O.O.O.[Ca++].CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC([O-])=O)C1=CC=C(F)C=C1)C1=CC=CC=C1.CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC([O-])=O)C1=CC=C(F)C=C1)C1=CC=CC=C1
Atorvastatin Calcium Salt Trihydrate 98.0+%, TCI America™
CAS: 344423-98-9 Molecular Formula: C66H74CaF2N4O13 Molecular Weight (g/mol): 1209.408 MDL Number: MFCD09752074 InChI Key: SHZPNDRIDUBNMH-NIJVSVLQSA-L PubChem CID: 656846 ChEBI: CHEBI:2911 IUPAC Name: calcium;(3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoate;trihydrate SMILES: CC(C)C1=C(C(=C(N1CCC(CC(CC(=O)[O-])O)O)C2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4.CC(C)C1=C(C(=C(N1CCC(CC(CC(=O)[O-])O)O)C2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4.O.O.O.[Ca+2]
Furan, 99%, stab. with ca 250ppm BHT
CAS: 110-00-9 Molecular Formula: C4H4O Molecular Weight (g/mol): 68.08 MDL Number: MFCD00003222 InChI Key: YLQBMQCUIZJEEH-UHFFFAOYSA-N Synonym: divinylene oxide,furfuran,tetrole,oxole,oxacyclopentadiene,furane,1,4-epoxy-1,3-butadiene,axole,rcra waste number u124,furfurane PubChem CID: 8029 ChEBI: CHEBI:35559 IUPAC Name: furan SMILES: O1C=CC=C1
2-Vinylpyrazine, 98%, stab. with ca 0.1% hydroquinone
CAS: 4177-16-6 Molecular Formula: C6H6N2 Molecular Weight (g/mol): 106.13 MDL Number: MFCD00051591 InChI Key: KANZWHBYRHQMKZ-UHFFFAOYSA-N Synonym: 2-vinylpyrazine,vinylpyrazine,pyrazine, ethenyl,pyrazine, vinyl,2-vinyl pyrazine,unii-y6tpk237o6,ethenylpyrazine,vinyl pyrazine,2ethenylpyrazine,acmc-20anmb PubChem CID: 77840 IUPAC Name: 2-ethenylpyrazine SMILES: C=CC1=CN=CC=N1
Hydrogen fluoride pyridine complex, ca 70% HF, Thermo Scientific Chemicals
CAS: 62778-11-4 Molecular Formula: C5H6FN Molecular Weight (g/mol): 99.108 MDL Number: MFCD00012436 InChI Key: GRJJQCWNZGRKAU-UHFFFAOYSA-N Synonym: pyridine hydrofluoride,hydrogen fluoride-pyridine,olah's reagent,pyridinium fluoride,hydrogen fluoride pyridine complex,hydrogen fluoride pyridine,hf-pyridine,pyridine, hydrofluoride 1:1,pyridinium poly hydrogen fluoride,hydrogen fluoride/pyridine PubChem CID: 64774 IUPAC Name: pyridine;hydrofluoride SMILES: C1=CC=NC=C1.F
Thermo Scientific Chemicals Adenine hydrochloride, 98+%, cont. up to ca 5% water
CAS: 2922-28-3 Molecular Formula: C5H6ClN5 Molecular Weight (g/mol): 171.59 MDL Number: MFCD00038990 InChI Key: UQVDQSWZQXDUJB-UHFFFAOYSA-N Synonym: adenine hydrochloride,7h-purin-6-amine hydrochloride,6-aminopurine hydrochloride,1h-purin-6-amine, monohydrochloride,adenine monohydrochloride,unii-364h11m7od,adenine hcl,1h-purin-6-amine, hydrochloride,9h-purin-6-amine, hydrochloride 1:?,9h-purin-6-amine, hydrochloride 1:1 PubChem CID: 76219 IUPAC Name: 7H-purin-6-amine;hydrochloride SMILES: Cl.NC1=C2NC=NC2=NC=N1
Sulfur trioxide-pyridine complex, 98%, active SO3 ca 48-50%
CAS: 26412-87-3 Molecular Formula: C5H5NO3S Molecular Weight (g/mol): 159.16 MDL Number: MFCD00012437 InChI Key: UDYFLDICVHJSOY-UHFFFAOYSA-N Synonym: pyridine sulfur trioxide,sulfur trioxide pyridine complex,pyridine; sulfur trioxide,pyridine sulfotrioxide,pyridine compound with sulfur trioxide 1:1,sulfur trioxide, compd. with pyridine,pyridine-sulfur trioxide complex,active sulfure trioxide,sulfur trioxide-pyridine,pyridine-sulfur trioxide PubChem CID: 168533 SMILES: O=S(=O)=O.C1=CC=NC=C1
Quinoline N-oxide hydrate, 97% (dry wt.), water ca 20%
CAS: 64201-64-5 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.16 MDL Number: MFCD00006737 InChI Key: GIIWGCBLYNDKBO-UHFFFAOYSA-N Synonym: quinoline n-oxide hydrate,quinoline, 1-oxide, monohydrate,1-oxidoquinolin-1-ium hydrate,quinoline-n-oxide hydrate,quinoline-1-oxide hydrate,quinolinol, oxamethane,acmc-1be96,quinoline 1-oxide monohydrate,quinoline n-oxide monohydrate PubChem CID: 152363 IUPAC Name: 1-oxidoquinolin-1-ium;hydrate SMILES: [O-][N+]1=CC=CC2=CC=CC=C12
5-Azacytosine, 98% (dry wt.), may cont. up to ca 7% water
CAS: 931-86-2 Molecular Formula: C3H4N4O Molecular Weight (g/mol): 112.09 MDL Number: MFCD00006033,MFCD00149402,MFCD00051007 InChI Key: MFEFTTYGMZOIKO-UHFFFAOYSA-N Synonym: 5-azacytosine,1,3,5-triazin-2 1h-one, 4-amino,4-amino-1,3,5-triazin-2 1h-one,4-amino-1,3,5-triazin-2-ol,4-amino-1,3,5-triazin-2-one,s-triazin-2 1h-one, 4-amino,s-triazin-2-ol, 4-amino,2-amino-4-hydroxy-s-triazine,6-amino-1,3,5-triazin-2 1h-one,4-amino-s-triazin-2 1h-one PubChem CID: 19956 ChEBI: CHEBI:72474 SMILES: NC1=NC=NC(=O)N1
Borane - Tetrahydrofuran Complex (8.5% in Tetrahydrofuran, ca. 0.9mol/L), TCI America™
CAS: 14044-65-6 Molecular Formula: C4H11BO Molecular Weight (g/mol): 85.94 MDL Number: MFCD00012429 InChI Key: RMCYTHFAWCWRFA-UHFFFAOYSA-N Synonym: borane-tetrahydrofuran complex,tetrahydrofuran borane,bh3.thf,borane tetrahydrofuran complex solution,borane-d3-thf complex solution,borane-tetrahydrofuran,unii-5ear4err1l,oxolane borane,boron; oxolane,borane thf PubChem CID: 11062302 IUPAC Name: oxolane borane SMILES: B.C1CCOC1
1-Acetylpiperidine-4-carbonyl chloride, 97%, may contain up to ca 1M free HCl
CAS: 59084-16-1 Molecular Formula: C8H12ClNO2 Molecular Weight (g/mol): 189.639 MDL Number: MFCD02094017 InChI Key: OHCPVLJEAHBMEG-UHFFFAOYSA-N Synonym: 1-acetylisonipecotoyl chloride,n-acetylisonipecotoyl chloride,1-acetyl-4-piperidinecarbonyl chloride,1-acetyl isonipecotoyl chloride,acmc-20aoys,acetylisonipecotoyl chloride,1acetylisonipecotoyl chloride,n-acetylisonipecotyl chloride,ksc274a6b,n-acetyl isonipecotoyl chloride PubChem CID: 100950 IUPAC Name: 1-acetylpiperidine-4-carbonyl chloride SMILES: CC(=O)N1CCC(CC1)C(=O)Cl
![Phenolphthalein (0.1% in ca. 90% Ethanol) [for Titration], TCI America™](https://assets.fishersci.com/TFS-Assets/CCG/Chemical-Structures/chemical-structure-cas-77-09-8.jpg-250.jpg)
Phenolphthalein (0.1% in ca. 90% Ethanol) [for Titration], TCI America™
CAS: 77-09-8 Molecular Formula: C20H14O4 Molecular Weight (g/mol): 318.33 MDL Number: MFCD00005913 InChI Key: KJFMBFZCATUALV-UHFFFAOYSA-N Synonym: phenolphthalein,phthalimetten,euchessina,phthalin,espotabs,phenolax,purgophen,koprol,laxogen,trilax PubChem CID: 4764 ChEBI: CHEBI:34914 IUPAC Name: 3,3-bis(4-hydroxyphenyl)-1,3-dihydro-2-benzofuran-1-one SMILES: OC1=CC=C(C=C1)C1(OC(=O)C2=CC=CC=C12)C1=CC=C(O)C=C1
![Methyl Red (0.1% in ca. 95% Ethanol) [for Titration], TCI America™](https://assets.fishersci.com/TFS-Assets/CCG/Chemical-Structures/chemical-structure-cas-493-52-7.jpg-250.jpg)
Methyl Red (0.1% in ca. 95% Ethanol) [for Titration], TCI America™
CAS: 493-52-7 Molecular Formula: C15H15N3O2 Molecular Weight (g/mol): 269.304 MDL Number: MFCD00002425 InChI Key: CEQFOVLGLXCDCX-UHFFFAOYSA-N Synonym: methyl red,o-methyl red,c.i. acid red 2,acid red 2,cerven methylova,cerven kysela 2,4-dimethylamino-2'-carboxylazobenzene,2-carboxy-4'-dimethylamino azobenzene,2-4-dimethylaminophenylazo benzoic acid,ci acid red 2 PubChem CID: 10303 IUPAC Name: 2-[[4-(dimethylamino)phenyl]diazenyl]benzoic acid SMILES: CN(C)C1=CC=C(C=C1)N=NC2=CC=CC=C2C(=O)O
![Phenol Red (0.1% in ca. 20% Ethanol) [for Titration], TCI America™](https://assets.fishersci.com/TFS-Assets/CCG/Chemical-Structures/chemical-structure-cas-143-74-8.jpg-250.jpg)
Phenol Red (0.1% in ca. 20% Ethanol) [for Titration], TCI America™
CAS: 143-74-8 Molecular Formula: C19H14O5S Molecular Weight (g/mol): 354.38 MDL Number: MFCD00003552 InChI Key: BELBBZDIHDAJOR-UHFFFAOYSA-N Synonym: phenol red,phenolsulfonphthalein,fenolipuna,sulfonphthal,sulphental,sulphonthal,phenolsulphonphthalein,psp indicator,phenolsulfonephthalein,unii-i6g9y0j1oj PubChem CID: 4766 ChEBI: CHEBI:31991 IUPAC Name: 3,3-bis(4-hydroxyphenyl)-3H-2,1λ⁶-benzoxathiole-1,1-dione SMILES: OC1=CC=C(C=C1)C1(OS(=O)(=O)C2=CC=CC=C12)C1=CC=C(O)C=C1
![Bromocresol Green (0.04% in ca. 50% Ethanol) [for Titration], TCI America™](https://assets.fishersci.com/TFS-Assets/CCG/Chemical-Structures/chemical-structure-cas-76-60-8.jpg-250.jpg)
Bromocresol Green (0.04% in ca. 50% Ethanol) [for Titration], TCI America™
CAS: 76-60-8 Molecular Formula: C21H14Br4O5S Molecular Weight (g/mol): 698.014 MDL Number: MFCD00005874 InChI Key: FRPHFZCDPYBUAU-UHFFFAOYSA-N Synonym: bromocresol green,bromcresol green,bromo cresol green,tetrabromo-m-cresolphthalein sulfone,3',3,5',5-tetrabromo-m-cresolsulfonephthalein,3,3-bis 3,5-dibromo-4-hydroxy-2-methylphenyl-3h-benzo c 1,2 oxathiole 1,1-dioxide,bromocresol blue,unii-8ygn0y942m,bromocresol green, acs,o-toluenesulfonic acid, alpha-hydroxy-, gamma-sultone PubChem CID: 6451 IUPAC Name: 2,6-dibromo-4-[3-(3,5-dibromo-4-hydroxy-2-methylphenyl)-1,1-dioxo-2,1$l^{6}-benzoxathiol-3-yl]-3-methylphenol SMILES: CC1=C(C(=C(C=C1C2(C3=CC=CC=C3S(=O)(=O)O2)C4=CC(=C(C(=C4C)Br)O)Br)Br)O)Br