Organic compounds
Tetraethylammonium acetate tetrahydrate, 96%
CAS: 67533-12-4 Molecular Formula: C10H23NO2·4H2O Molecular Weight (g/mol): 261.35 InChI Key: QNOAKQGNSWGYOE-UHFFFAOYSA-M Synonym: tetraethylammonium acetate tetrahydrate,ethanaminium, n,n,n-triethyl-, acetate, tetrahydrate,tetraethylazanium acetate tetrahydrate,tetraethylazanium ethanoate tetrahydrate,acetate ion tetraethylammonium tetrahydrate,ethanaminium,n,n,n-triethyl-,acetate,tetrahydrate PubChem CID: 2724098 IUPAC Name: tetraethylazanium;acetate;tetrahydrate SMILES: CC[N+](CC)(CC)CC.CC(=O)[O-].O.O.O.O
1-Propanephosphonic acid cyclic anhydride, 50 wt.% solution in dimethylformamide, Thermo Scientific Chemicals
CAS: 68957-94-8 Molecular Formula: C9H21O6P3 Molecular Weight (g/mol): 318.18 MDL Number: MFCD00006583 InChI Key: PAQZWJGSJMLPMG-UHFFFAOYSA-N Synonym: 2,4,6-tripropyl-1,3,5,2,4,6-trioxatriphosphorinane-2,4,6-trioxide,1-propanephosphonic acid cyclic anhydride,2,4,6-tripropyl-1,3,5,2,4,6-trioxatriphosphinane 2,4,6-trioxide,unii-i6egd8839n,1,3,5,2,4,6-trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide,propane phosphonic acid anhydride,2,4,6-tripropyl-1,3,5,2,4,6-trioxatriphosphorinane 2,4,6-trioxide,1-propanephosphonic anhydride in thf,2,4,6-tri-n-propyl-2,4,6-trioxo-1,3,5,2,4,6-trioxatriphosphorinane,1-propanephosphonic anhydride in toluene,t3p PubChem CID: 111923 IUPAC Name: 2,4,6-tripropyl-1,3,5,2$l^{5},4$l^{5},6$l^{5}-trioxatriphosphinane 2,4,6-trioxide SMILES: CCCP1(=O)OP(=O)(OP(=O)(O1)CCC)CCC
Cyclohexyl isocyanide, 99%
CAS: 931-53-3 Molecular Formula: C7H11N Molecular Weight (g/mol): 109.17 MDL Number: MFCD00003839 InChI Key: XYZMOVWWVXBHDP-UHFFFAOYSA-N Synonym: cyclohexyl isocyanide,cyclohexane, isocyano,cyclohexylisocyanide,cyclohexaneisonitrile,cyclohexyl isonitrile,n-cyclohexylisocyanide,cyi,cyclohexylisonitrile,isocyano-cyclohexane,cyclohexyliminocarbene PubChem CID: 79129 ChEBI: CHEBI:17966 IUPAC Name: isocyanocyclohexane SMILES: [C-]#[N+]C1CCCCC1
Veratraldehyde, 99%
CAS: 120-14-9 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00003363 InChI Key: WJUFSDZVCOTFON-UHFFFAOYSA-N Synonym: veratraldehyde,veratric aldehyde,methylvanillin,vanillin methyl ether,veratral,veratryl aldehyde,benzaldehyde, 3,4-dimethoxy,veratrum aldehyde,p-veratric aldehyde,4-o-methylvanillin PubChem CID: 8419 ChEBI: CHEBI:17098 IUPAC Name: 3,4-dimethoxybenzaldehyde SMILES: COC1=CC=C(C=O)C=C1OC
Trichloroacetic acid, sodium salt, 97%
CAS: 650-51-1 Molecular Formula: C2Cl3NaO2 Molecular Weight (g/mol): 185.36 MDL Number: MFCD00064198 InChI Key: SAQSTQBVENFSKT-UHFFFAOYSA-M Synonym: sodium trichloroacetate,tca-sodium,trichloroacetic acid sodium salt,antiperz,antyperz,tca sodium,acp grass killer,sodium tca,varitox,stca PubChem CID: 23681045 ChEBI: CHEBI:81976 IUPAC Name: sodium;2,2,2-trichloroacetate SMILES: C(=O)(C(Cl)(Cl)Cl)[O-].[Na+]
Tamoxifen citrate
CAS: 54965-24-1 Molecular Formula: C32H37NO8 Molecular Weight (g/mol): 563.65 MDL Number: MFCD00058321 InChI Key: FQZYTYWMLGAPFJ-OQKDUQJOSA-N Synonym: tamoxifen citrate,istubal,zitazonium,unii-7frv7310n6,i.c.i. 46474 citrate,tamoxifen citrate salt,farmifeno,ginarsan,jenoxifen PubChem CID: 2733525 ChEBI: CHEBI:9397 IUPAC Name: (2-{4-[(1Z)-1,2-diphenylbut-1-en-1-yl]phenoxy}ethyl)dimethylamine; 2-hydroxypropane-1,2,3-tricarboxylic acid SMILES: OC(=O)CC(O)(CC(O)=O)C(O)=O.CC\C(=C(/C1=CC=CC=C1)C1=CC=C(OCCN(C)C)C=C1)C1=CC=CC=C1
3-Hydroxy-3-methyl-2-butanone, 92%
CAS: 115-22-0 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.13 MDL Number: MFCD00004460 InChI Key: BNDRWEVUODOUDW-UHFFFAOYSA-N Synonym: 3-hydroxy-3-methyl-2-butanone,3-methylacetoin,methylacetoin,2-butanone, 3-hydroxy-3-methyl,dimethylacetylcarbinol,2-hydroxy-2-methyl-3-butanone,2-methyl-2-hydroxybutan-3-one,1-hydroxy-1-methylethyl methyl ketone,3-hydroxy-3-methyl-butan-2-one,3-hydroxy-3-ethylbutanone PubChem CID: 8261 IUPAC Name: 3-hydroxy-3-methylbutan-2-one SMILES: CC(=O)C(C)(C)O
1-Decene, 96%, remainder isomers
CAS: 872-05-9 Molecular Formula: C10H20 Molecular Weight (g/mol): 140.27 MDL Number: MFCD00009577 InChI Key: AFFLGGQVNFXPEV-UHFFFAOYSA-N Synonym: 1-decene,decylene,decene,n-1-decene,1-n-decene,alpha-decene,n-decylene,gulftene 10,dialene 10,decene-1 PubChem CID: 13381 ChEBI: CHEBI:87315 IUPAC Name: dec-1-ene SMILES: CCCCCCCCC=C
Perfluoro-n-octane, 98%, Thermo Scientific Chemicals
CAS: 307-34-6 Molecular Formula: C8F18 Molecular Weight (g/mol): 438.059 MDL Number: MFCD00042083 InChI Key: YVBBRRALBYAZBM-UHFFFAOYSA-N Synonym: perfluorooctane,octadecafluorooctane,n-perfluorooctane,octane, octadecafluoro,eftop ef-l 100,unii-6p60zbk0ql,n-perfluoro octane,perfluoro-n-octane,octadecafluoro-n-octane,6p60zbk0ql PubChem CID: 9387 ChEBI: CHEBI:38826 IUPAC Name: 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-octadecafluorooctane SMILES: C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F
3-(3,4-Dimethoxyphenyl)propionic acid, 98%
CAS: 2107-70-2 Molecular Formula: C11H14O4 Molecular Weight (g/mol): 210.229 MDL Number: MFCD00002774 InChI Key: LHHKQWQTBCTDQM-UHFFFAOYSA-N Synonym: 3-3,4-dimethoxyphenyl propionic acid,3-3,4-dimethoxyphenyl propanoic acid,3,4-dimethoxyhydrocinnamic acid,benzenepropanoic acid, 3,4-dimethoxy,3-3,4-dimethoxyphenyl-propionic acid,3-3,4-dimethoxy-phenyl-propionic acid,unii-6xo32zsp1d,6xo32zsp1d,3-3',4'-dimethoxyphenyl propanoic acid,3-3,4-dimethoxyphenyl propionicacid PubChem CID: 75019 ChEBI: CHEBI:44235 IUPAC Name: 3-(3,4-dimethoxyphenyl)propanoic acid SMILES: COC1=C(C=C(C=C1)CCC(=O)O)OC
Salbutamol hemisulfate, 98+%
CAS: 51022-70-9 Molecular Formula: C13H23NO7S Molecular Weight (g/mol): 337.387 MDL Number: MFCD00055200 InChI Key: OVICLFZZVQVVFT-UHFFFAOYSA-N Synonym: salbutamol sulfate,albuterol sulfate,ventolin,ventorlin,4-2-tert-butylamino-1-hydroxyethyl-2-hydroxymethyl phenol sulfate,asthavent,albuterol sulfate 1:x,salbutamol; sulfuric acid,asmaven sulfate,2-tert-butylamino-1-4-hydroxy-3-hydroxymethylphenyl ethanol hemisulfate PubChem CID: 9884233 IUPAC Name: 4-[2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol;sulfuric acid SMILES: CC(C)(C)NCC(C1=CC(=C(C=C1)O)CO)O.OS(=O)(=O)O
5-(N-2,3-Dihydroxypropylacetimido)-2,4,6-triiodo-N,N'-bis-(2,3-dihydroxypropyl)isophthalamide, MP Biomedicals™
CAS: 66108-95-0 Molecular Formula: C19H26I3N3O9 Molecular Weight (g/mol): 821.14 MDL Number: MFCD00077732 InChI Key: NTHXOOBQLCIOLC-UHFFFAOYNA-N Synonym: Nycodenz,Histodenz™
1-Bromo-2-methylpropane, 98+%
CAS: 78-77-3 Molecular Formula: C4H9Br Molecular Weight (g/mol): 137.02 MDL Number: MFCD00000217 InChI Key: HLVFKOKELQSXIQ-UHFFFAOYSA-N Synonym: isobutyl bromide,iso-butyl bromide,propane, 1-bromo-2-methyl,bromoisobutane,i-butyl bromide,1-bromo-2-methyl-propane,unii-5oec0bw987,ccris 349,1-bromo-2-methyl propane,bromoacetaldehydedimethylacetal PubChem CID: 6555 IUPAC Name: 1-bromo-2-methylpropane SMILES: CC(C)CBr
Diethyl methylmalonate, 99%
CAS: 609-08-5 Molecular Formula: C8H14O4 Molecular Weight (g/mol): 174.2 MDL Number: MFCD00009162 InChI Key: UPQZOUHVTJNGFK-UHFFFAOYSA-N Synonym: diethyl methylmalonate,methylmalonic acid diethyl ester,diethyl 2-methylmalonate,propanedioic acid, methyl-, diethyl ester,1,3-diethyl 2-methylpropanedioate,diethylmethylmalonate,ethyl methylmalonate,diethyl methylpropanedioate,malonic acid, methyl-, diethyl ester,2-methylmalonic acid diethyl PubChem CID: 11857 IUPAC Name: diethyl 2-methylpropanedioate SMILES: CCOC(=O)C(C)C(=O)OCC
DL-2-Aminobutyric acid, 99%
CAS: 2835-81-6 Molecular Formula: C4H9NO2 Molecular Weight (g/mol): 103.12 InChI Key: QWCKQJZIFLGMSD-UHFFFAOYSA-N Synonym: dl-2-aminobutyric acid,2-aminobutyric acid,alpha-aminobutyric acid,butanoic acid, 2-amino,butyrine,dl-2-amino-n-butyric acid,h-dl-abu-oh,aaba,dl-alpha-amino-n-butyric acid,alpha-amino-n-butyric acid PubChem CID: 6657 ChEBI: CHEBI:35621 IUPAC Name: 2-aminobutanoic acid SMILES: CCC(C(=O)O)N