Organooxygen compounds
trans-1,4-Cyclohexanediol 97.0+%, TCI America™
CAS: 6995-79-5 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00063612 InChI Key: VKONPUDBRVKQLM-UHFFFAOYSA-N Synonym: trans-1,4-Dihydroxycyclohexane PubChem CID: 11162 IUPAC Name: cyclohexane-1,4-diol SMILES: C1CC(CCC1O)O
4'-Aminohexanophenone 98.0+%, TCI America™
CAS: 38237-76-2 Molecular Formula: C12H17NO Molecular Weight (g/mol): 191.274 InChI Key: YDQJFPLRVSPPGE-UHFFFAOYSA-N Synonym: 4-Hexanoylaniline PubChem CID: 37983 IUPAC Name: 1-(4-aminophenyl)hexan-1-one SMILES: CCCCCC(=O)C1=CC=C(C=C1)N
Allyl Ether 98.0+%, TCI America™
CAS: 557-40-4 Molecular Formula: C6H10O Molecular Weight (g/mol): 98.145 MDL Number: MFCD00008650 InChI Key: ATVJXMYDOSMEPO-UHFFFAOYSA-N Synonym: Diallyl Ether PubChem CID: 11194 IUPAC Name: 3-prop-2-enoxyprop-1-ene SMILES: C=CCOCC=C
4'-Chloro-3'-nitroacetophenone 98.0+%, TCI America™
CAS: 5465-65-6 Molecular Formula: C8H6ClNO3 Molecular Weight (g/mol): 199.59 MDL Number: MFCD00007083 InChI Key: YEVPHFIFGUWSMG-UHFFFAOYSA-N Synonym: 4'-chloro-3'-nitroacetophenone,1-4-chloro-3-nitrophenyl ethanone,4-chloro-3-nitroacetophenone,ethanone, 1-4-chloro-3-nitrophenyl,1-4-chloro-3-nitrophenyl ethan-1-one,unii-gkv85f2zxl,acetophenone, 4'-chloro-3'-nitro,gkv85f2zxl,4-chloro-3'-nitroacetophenone,3'-nitro-4'-chloro acetophenone PubChem CID: 79596 IUPAC Name: 1-(4-chloro-3-nitrophenyl)ethan-1-one SMILES: CC(=O)C1=CC=C(Cl)C(=C1)[N+]([O-])=O
3'-Chloro-4'-fluoroacetophenone 98.0+%, TCI America™
CAS: 2923-66-2 Molecular Formula: C8H6ClFO Molecular Weight (g/mol): 172.58 MDL Number: MFCD00042203 InChI Key: PCJPESKRPOTNGU-UHFFFAOYSA-N Synonym: 3'-chloro-4'-fluoroacetophenone,3-chloro-4-fluoroacetophenone,1-3-chloro-4-fluorophenyl ethanone,1-3-chloro-4-fluorophenyl ethan-1-one,ethanone, 1-3-chloro-4-fluorophenyl,1-3-chloro-4-fluoro-phenyl-ethanone,1-acetyl-3-chloro-4-fluorobenzene,pubchem4202,ksc699k7b,3-chloro-4-fluoro acetophenone PubChem CID: 520422 IUPAC Name: 1-(3-chloro-4-fluorophenyl)ethan-1-one SMILES: CC(=O)C1=CC=C(F)C(Cl)=C1
4-Acetylbenzoic Acid 98.0+%, TCI America™
CAS: 586-89-0 Molecular Formula: C9H8O3 Molecular Weight (g/mol): 164.16 MDL Number: MFCD00002561 InChI Key: QBHDSQZASIBAAI-UHFFFAOYSA-N Synonym: benzoic acid, 4-acetyl,p-acetylbenzoic acid,4-acetyl-benzoic acid,4'-acetophenonecarboxylic acid,4-acetylbezoic acid,4-acetylbenzoci acid,4'-carboxyacetohenone,pubchem3129,4-acetyl benzoic acid PubChem CID: 11470 IUPAC Name: 4-acetylbenzoic acid SMILES: CC(=O)C1=CC=C(C=C1)C(=O)O
Benzyl Acetoacetate 95.0+%, TCI America™
CAS: 5396-89-4 Molecular Formula: C11H12O3 Molecular Weight (g/mol): 192.214 MDL Number: MFCD00008785 InChI Key: WOFAGNLBCJWEOE-UHFFFAOYSA-N Synonym: benzyl acetoacetate,acetoacetic acid benzyl ester,benzyl acetylacetate,acetoacetic acid, benzyl ester,phenylmethyl 3-oxobutanoate,butanoic acid, 3-oxo-, phenylmethyl ester,benzyl beta-ketobutyrate,ac-benzyl,unii-f9s0xgv18x,f9s0xgv18x PubChem CID: 142266 IUPAC Name: benzyl 3-oxobutanoate SMILES: CC(=O)CC(=O)OCC1=CC=CC=C1
5-Acetoxymethylfurfural 98.0+%, TCI America™
CAS: 10551-58-3 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.148 MDL Number: MFCD00003233 InChI Key: QAVITTVTXPZTSE-UHFFFAOYSA-N Synonym: 5-acetoxymethyl-2-furaldehyde,5-formylfuran-2-yl methyl acetate,5-acetoxymethylfurfural,5-acetoxymethyl furfural,5-formylfurfuryl acetate,5-formyl-2-furyl methyl acetate,unii-5hh6180xyd,5-acetoxymethyl furfural amf,2-furancarboxaldehyde, 5-acetyloxy methyl PubChem CID: 66349 IUPAC Name: (5-formylfuran-2-yl)methyl acetate SMILES: CC(=O)OCC1=CC=C(O1)C=O
Efavirenz 98.0+%, TCI America™
CAS: 154598-52-4 Molecular Formula: C14H9ClF3NO2 Molecular Weight (g/mol): 315.676 MDL Number: MFCD05662344 InChI Key: XPOQHMRABVBWPR-ZDUSSCGKSA-N Synonym: (4S)-6-Chloro-4-(2-cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-2H-3,1-benzoxazin-2-one PubChem CID: 64139 ChEBI: CHEBI:119486 IUPAC Name: (4S)-6-chloro-4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one SMILES: C1CC1C#CC2(C3=C(C=CC(=C3)Cl)NC(=O)O2)C(F)(F)F
Ethyl 1,1,2,2-Tetrafluoroethyl Ether 98.0+%, TCI America™
CAS: 512-51-6 Molecular Formula: C4H6F4O Molecular Weight (g/mol): 146.09 MDL Number: MFCD00069162 InChI Key: HBRLMDFVVMYNFH-UHFFFAOYSA-N Synonym: ethyl 1,1,2,2-tetrafluoroethyl ether,374pce-beta-gamma,1,1,2,2-tetrafluoroethyl ethyl ether,ethane, 1-ethoxy-1,1,2,2-tetrafluoro,ether, ethyl 1,1,2,2-tetrafluoroethyl,acmc-1anqb,1,1,2,2-tetrafluoroethyl ether,1,1,2,2-tetrafluoroethoxyethane,1,1,2,2-tetrafluoro ethyl ether,3-oxa-1,1,2,2-tetrafluoropentane PubChem CID: 120272 IUPAC Name: 1-ethoxy-1,1,2,2-tetrafluoroethane SMILES: CCOC(F)(F)C(F)F
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-Benzyloxybenzaldehyde 98.0+%, TCI America™
CAS: 1700-37-4 Molecular Formula: C14H12O2 Molecular Weight (g/mol): 212.248 MDL Number: MFCD00003367 InChI Key: JAICGBJIBWDEIZ-UHFFFAOYSA-N Synonym: 3-benzyloxybenzaldehyde,3-benzyloxy benzaldehyde,benzaldehyde, 3-phenylmethoxy,m-benzyloxybenzaldehyde,benzaldehyde, m-benzyloxy,3-phenylmethoxy benzaldehyde,3-benzyloxy-benzaldehyde,unii-k1s6ob2gnn,k1s6ob2gnn PubChem CID: 74342 IUPAC Name: 3-phenylmethoxybenzaldehyde SMILES: C1=CC=C(C=C1)COC2=CC=CC(=C2)C=O
2-Bromo-4'-(trifluoromethyl)acetophenone 95.0+%, TCI America™
CAS: 383-53-9 Molecular Formula: C9H6BrF3O Molecular Weight (g/mol): 267.05 MDL Number: MFCD00126489 InChI Key: HEMROKPXTCOASZ-UHFFFAOYSA-N Synonym: 2-bromo-1-4-trifluoromethyl phenyl ethan-1-one,4-trifluoromethyl phenacyl bromide,2-bromo-4'-trifluoromethyl acetophenone,2-bromo-1-4-trifluoromethyl phenyl ethanone,2-bromo-4'-trifluoromethyl acetophenon,4-trifluoromethylphenacyl bromide,ethanone, 2-bromo-1-4-trifluoromethyl phenyl,4'-trifluoromethyl phenacyl bromide,2-bromo-4'-trifluoromethylacetophenone PubChem CID: 321979 IUPAC Name: 2-bromo-1-[4-(trifluoromethyl)phenyl]ethan-1-one SMILES: FC(F)(F)C1=CC=C(C=C1)C(=O)CBr
Bis(2-butoxyethyl) Adipate 97.0+%, TCI America™
CAS: 141-18-4 Molecular Formula: C18H34O6 Molecular Weight (g/mol): 346.46 MDL Number: MFCD00053796 InChI Key: IHTSDBYPAZEUOP-UHFFFAOYSA-N Synonym: Adipic Acid Bis(2-butoxyethyl) Ester, Adipic Acid Di(2-butoxyethyl) Ester, Di(2-butoxyethyl) Adipate PubChem CID: 8837 IUPAC Name: 1,6-bis(2-butoxyethyl) hexanedioate SMILES: CCCCOCCOC(=O)CCCCC(=O)OCCOCCCC