Organooxygen compounds
Ethyl 4-Chloroacetoacetate 95.0+%, TCI America™
CAS: 638-07-3 Molecular Formula: C6H9ClO3 Molecular Weight (g/mol): 164.585 MDL Number: MFCD00000939 InChI Key: OHLRLMWUFVDREV-UHFFFAOYSA-N Synonym: ethyl 4-chloroacetoacetate,4-chloroacetoacetic acid ethyl ester,butanoic acid, 4-chloro-3-oxo-, ethyl ester,ethyl gamma-chloroacetoacetate,unii-5ae82250cm,ccris 6791,ethyl chloroacetyl acetate,butanoic acid, 4-chloro-3-oxo-ethylester,ethyl 4-chloro-3-oxobutyrate,ethyl 4-chloro-3-oxo-butanoate PubChem CID: 69484 IUPAC Name: ethyl 4-chloro-3-oxobutanoate SMILES: CCOC(=O)CC(=O)CCl
Bis(2,4-pentanedionato)calcium(II) 98.0+%, TCI America™
CAS: 19372-44-2 Molecular Formula: C10H18CaO6 Molecular Weight (g/mol): 274.326 MDL Number: MFCD00013486 InChI Key: FTDUGYDPOWCKTD-VGKOASNMSA-L Synonym: Acetylacetone Calcium(II) Salt, Calcium(II) Acetylacetonate PubChem CID: 131675864 IUPAC Name: calcium;(Z)-4-oxopent-2-en-2-olate;dihydrate SMILES: CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].O.O.[Ca+2]
4'-Chlorobutyrophenone 98.0+%, TCI America™
CAS: 4981-63-9 Molecular Formula: C10H11ClO Molecular Weight (g/mol): 182.65 MDL Number: MFCD00013647 InChI Key: XLCJPQYALLFIPW-UHFFFAOYSA-N Synonym: 4'-chlorobutyrophenone,p-chlorobutyrophenone,1-4-chlorophenyl butan-1-one,1-butanone, 1-4-chlorophenyl,butyrophenone, 4'-chloro,4-chlorophenyl propyl ketone,acmc-1al89,xlcjpqyallfipw-uhfffaoysa,1-4-chlorophenyl-1-butanone # PubChem CID: 70321 IUPAC Name: 1-(4-chlorophenyl)butan-1-one SMILES: CCCC(=O)C1=CC=C(Cl)C=C1
4-(Trifluoromethyl)cyclohexanol (cis- and trans- mixture) 98.0+%, TCI America™
CAS: 30129-18-1 Molecular Formula: C7H11F3O Molecular Weight (g/mol): 168.159 MDL Number: MFCD00102144 InChI Key: VJUJYNJEPPWWHS-UHFFFAOYSA-N Synonym: 4-trifluoromethyl cyclohexanol,trans-4-trifluoromethyl cyclohexanol,4-trifluoromethyl cyclohexan-1-ol,4-trifluoromethylcyclohexanol,1r,4r-4-trifluoromethyl cyclohexanol,4-trifluoromethyl-cyclohexanol,4-trifluoromethyl cyclohexanol, cis/trans,cyclohexanol, 4-trifluoromethyl,cyclohexanol, 4-trifluoromethyl-, cis,cyclohexanol,4-trifluoromethyl-, trans PubChem CID: 2779765 IUPAC Name: 4-(trifluoromethyl)cyclohexan-1-ol SMILES: C1CC(CCC1C(F)(F)F)O
3-Bromopyruvic Acid 98.0+%, TCI America™
CAS: 1113-59-3 Molecular Formula: C3H3BrO3 Molecular Weight (g/mol): 166.958 MDL Number: MFCD00002587 InChI Key: PRRZDZJYSJLDBS-UHFFFAOYSA-N Synonym: 3-bromopyruvic acid,bromopyruvic acid,bromopyruvate,3-bromopyruvate,3-bromo-2-oxopropionic acid,bromopyruvicacid,pyruvic acid, bromo,propanoic acid, 3-bromo-2-oxo,unii-63jmv04grk,.beta.-bromopyruvic acid PubChem CID: 70684 IUPAC Name: 3-bromo-2-oxopropanoic acid SMILES: C(C(=O)C(=O)O)Br
Benzyl L-(+)-Mandelate 98.0+%, TCI America™
CAS: 62173-99-3 Molecular Formula: C15H14O3 Molecular Weight (g/mol): 242.274 MDL Number: MFCD00274325 InChI Key: JFKWZVQEMSKSBU-AWEZNQCLSA-N Synonym: L-(+)-Mandelic Acid Benzyl Ester PubChem CID: 667423 IUPAC Name: benzyl (2S)-2-hydroxy-2-phenylacetate SMILES: C1=CC=C(C=C1)COC(=O)C(C2=CC=CC=C2)O
2',4',6'-Trimethylacetophenone 97.0+%, TCI America™
CAS: 1667-01-2 Molecular Formula: C11H14O Molecular Weight (g/mol): 162.23 MDL Number: MFCD00008735 InChI Key: XWCIICLTKWRWCI-UHFFFAOYSA-N Synonym: 1-mesitylethanone,2',4',6'-trimethylacetophenone,acetylmesitylene,acetomesitylene,mesityl methyl ketone,1-2,4,6-trimethylphenyl ethanone,ethanone, 1-2,4,6-trimethylphenyl,2-acetylmesitylene,2,4,6-trimethylacetophenone,methyl 2,4,6-trimethylphenyl ketone PubChem CID: 15461 IUPAC Name: 1-(2,4,6-trimethylphenyl)ethan-1-one SMILES: CC(=O)C1=C(C)C=C(C)C=C1C
2,2'-O-Cyclocytidine Hydrochloride 98.0+%, TCI America™
CAS: 10212-25-6 Molecular Formula: C9H12ClN3O4 Molecular Weight (g/mol): 261.66 MDL Number: MFCD00012636 InChI Key: KZOWNALBTMILAP-JBMRGDGGSA-N Synonym: cyclocytidine hydrochloride 1g PubChem CID: 74764394 ChEBI: CHEBI:74843 IUPAC Name: (2R,4R,5R,6S)-4-(hydroxymethyl)-10-imino-3,7-dioxa-1,9-diazatricyclo[6.4.0.0²,⁶]dodeca-8,11-dien-5-ol hydrochloride SMILES: Cl.OC[C@H]1O[C@@H]2[C@@H](OC3=NC(=N)C=CN23)[C@@H]1O
2-Propoxynaphthalene, TCI America™
CAS: 19718-45-7 Molecular Formula: C13H14O Molecular Weight (g/mol): 186.25 MDL Number: MFCD00021610 InChI Key: UEXFDEKTELCPNF-UHFFFAOYSA-N Synonym: 2-Naphthyl Propyl Ether PubChem CID: 243587 IUPAC Name: 2-propoxynaphthalene SMILES: CCCOC1=CC=C2C=CC=CC2=C1
1,3-Butanediol 99.0+%, TCI America™
CAS: 107-88-0 Molecular Formula: C4H10O2 Molecular Weight (g/mol): 90.122 MDL Number: MFCD00004554 InChI Key: PUPZLCDOIYMWBV-UHFFFAOYSA-N Synonym: 1,3-butanediol,1,3-butylene glycol,1,3-dihydroxybutane,methyltrimethylene glycol,1,3-butandiol,1-methyl-1,3-propanediol,beta-butylene glycol,1,3 butylene glycol,1,3-butylenglykol,rs-1,3-butandiol PubChem CID: 7896 ChEBI: CHEBI:52683 IUPAC Name: butane-1,3-diol SMILES: CC(CCO)O
2,2-Bis(4-hydroxycyclohexyl)propane (mixture of isomers) 93.0+%, TCI America™
CAS: 80-04-6 Molecular Formula: C15H28O2 Molecular Weight (g/mol): 240.387 MDL Number: MFCD00019334 InChI Key: CDBAMNGURPMUTG-UHFFFAOYSA-N PubChem CID: 94932 IUPAC Name: 4-[2-(4-hydroxycyclohexyl)propan-2-yl]cyclohexan-1-ol SMILES: CC(C)(C1CCC(CC1)O)C2CCC(CC2)O
2-(2-Bromoethyl)-1,3-dioxolane 90.0+%, TCI America™
CAS: 18742-02-4 Molecular Formula: C5H9BrO2 Molecular Weight (g/mol): 181.03 MDL Number: MFCD00003216 InChI Key: GGZQLTVZPOGLCC-UHFFFAOYSA-N Synonym: 2-2-bromoethyl-1,3-dioxolane,1,3-dioxolane, 2-2-bromoethyl,bromoethyl-1,3-dioxolane,acmc-1bol0,2-2-bromoethyl-dioxolane,ksc496m8b,2-bromoethyl-1,3-dioxolane,2 2-bromoethyl-1,3-dioxolane,2-2-bromoethyl-1,3-dioxolan PubChem CID: 87776 IUPAC Name: 2-(2-bromoethyl)-1,3-dioxolane SMILES: BrCCC1OCCO1
1-Butoxy-2-propanol 96.0+%, TCI America™
CAS: 5131-66-8 Molecular Formula: C7H16O2 Molecular Weight (g/mol): 132.203 MDL Number: MFCD00021904 InChI Key: RWNUSVWFHDHRCJ-UHFFFAOYSA-N Synonym: Propylene Glycol 1-Monobutyl Ether PubChem CID: 21210 IUPAC Name: 1-butoxypropan-2-ol SMILES: CCCCOCC(C)O
1-Bromo-3,3,3-trifluoroacetone 95.0+%, TCI America™
CAS: 431-35-6 Molecular Formula: C3H2BrF3O Molecular Weight (g/mol): 190.95 MDL Number: MFCD00039237 InChI Key: ONZQYZKCUHFORE-UHFFFAOYSA-N Synonym: 3-bromo-1,1,1-trifluoroacetone,1-bromo-3,3,3-trifluoroacetone,bromotrifluoroacetone,3-bromo-1,1,1-trifluoro-2-propanone,3-bromo-1,1,1-trifluoropropanone,1-bromo-3,3,3-trifluoro-2-propanone,2-propanone, 3-bromo-1,1,1-trifluoro,1,1,1-trifluoro-3-bromopropanone,3-bromo-1,1,1-trifluoro-propan-2-one,bromotrifloroacetone PubChem CID: 79008 IUPAC Name: 3-bromo-1,1,1-trifluoropropan-2-one SMILES: FC(F)(F)C(=O)CBr
