Organooxygen compounds
2,5-Bis(3,7-dimethyloctyloxy)terephthalaldehyde, 98%
CAS: 325461-35-6 Molecular Formula: C28H46O4 Molecular Weight (g/mol): 446.672 MDL Number: MFCD03427237 InChI Key: JMACLBZCZVVLDQ-UHFFFAOYSA-N Synonym: 2,5-bis 3,7-dimethyloctyloxy terephthalaldehyde,2,5-bis 3,7-dimethyloctoxy terephthalaldehyde,2,5-bis-3,7-dimethyloctyloxy terephthalaldehyde,2,5-bis 3,7-dimethyloctyl oxy benzene-1,4-dicarbaldehyde PubChem CID: 3653721 IUPAC Name: 2,5-bis(3,7-dimethyloctoxy)terephthalaldehyde SMILES: CC(C)CCCC(C)CCOC1=CC(=C(C=C1C=O)OCCC(C)CCCC(C)C)C=O
2,5-Dimethyl-2-hexanol, 98%
CAS: 3730-60-7 Molecular Formula: C8H18O Molecular Weight (g/mol): 130.23 MDL Number: MFCD00021814 InChI Key: JPUIYNHIEXIFMV-UHFFFAOYSA-N Synonym: 2,5-dimethyl-2-hexanol,2-hexanol, 2,5-dimethyl-, s,2-hexanol, 2,5-dimethyl,2-hexanol, 2,5-dimethyl-, s-+,acmc-209is7,2-hexanol,2,5-dimethyl,2-hexanol,5-dimethyl-, s,2-hexanol,5-dimethyl-, s-+ PubChem CID: 19506 IUPAC Name: 2,5-dimethylhexan-2-ol SMILES: CC(C)CCC(C)(C)O
5,6-Dimethoxyindole, 98%, Thermo Scientific Chemicals
CAS: 14430-23-0 Molecular Formula: C10H11NO2 Molecular Weight (g/mol): 177.20 MDL Number: MFCD00005675 InChI Key: QODBZRNBPUPLEZ-UHFFFAOYSA-N PubChem CID: 84431 IUPAC Name: 5,6-dimethoxy-1H-indole SMILES: COC1=C(OC)C=C2C=CNC2=C1
Ethyl 2-ethylacetoacetate, 95%
CAS: 607-97-6 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.197 MDL Number: MFCD00039898 InChI Key: OKANYBNORCUPKZ-UHFFFAOYSA-N Synonym: ethyl 2-ethylacetoacetate,ethyl 2-acetylbutyrate,butanoic acid, 2-ethyl-3-oxo-, ethyl ester,2-ethylacetoacetic acid ethyl ester,ethyl 2-ethyl-3-ketobutyrate,ethyl alpha-ethylacetoacetate,ethyl-2-ethylacetoacetate,2-ethyl-3-oxo-butyric acid ethyl ester,ethyl .alpha.-acetylbutyrate,ethyl 2-ethyl-3-oxo-butanoate PubChem CID: 79065 IUPAC Name: ethyl 2-ethyl-3-oxobutanoate SMILES: CCC(C(=O)C)C(=O)OCC
4,4,4-Trifluoro-1-butanol, 97%
CAS: 461-18-7 Molecular Formula: C4H7F3O Molecular Weight (g/mol): 128.094 MDL Number: MFCD00041483 InChI Key: VKRFUGHXKNNIJO-UHFFFAOYSA-N Synonym: 4,4,4-trifluoro-1-butanol,4,4,4-trifluorobutanol,4,4,4-trifluorobutanol-1,4,4,4-trifluoro-butan-1-ol,1-butanol, 4,4,4-trifluoro,pubchem15240,dl-bicarnesine hydrochloride,ksc237k9h,4,4,4-trifluoro-1-butanol #,4,4,4-tris fluoranyl butan-1-ol PubChem CID: 136307 IUPAC Name: 4,4,4-trifluorobutan-1-ol SMILES: C(CC(F)(F)F)CO
3-Methyl-1-pentanol, 98%
CAS: 589-35-5 Molecular Formula: C6H14O Molecular Weight (g/mol): 102.177 MDL Number: MFCD00002937 InChI Key: IWTBVKIGCDZRPL-UHFFFAOYSA-N Synonym: 3-methyl-1-pentanol,3-methylpentanol,1-pentanol, 3-methyl,2-ethyl-4-butanol,3-ethyl-1-butanol,3-ethylbutanol,3-methyl pentanol,fema no. 3762,3-methyl pentan-1-ol,3-methyl-pentan-1-ol PubChem CID: 11508 ChEBI: CHEBI:87381 IUPAC Name: 3-methylpentan-1-ol SMILES: CCC(C)CCO
2-Hexanoylfuran, 99%
CAS: 14360-50-0 Molecular Formula: C10H14O2 Molecular Weight (g/mol): 166.22 MDL Number: MFCD00037354 InChI Key: YUAYWSBSIJVIBS-UHFFFAOYSA-N Synonym: 2-hexanoylfuran,2-furyl pentyl ketone,1-hexanone, 1-2-furanyl,pentyl 2-furyl ketone,1-2-furyl-1-hexanone,1-furan-2-yl hexan-1-one,1-2-furyl hexanone,2-furyl n-pentyl ketone,1-2-furanyl-1-hexanone,furan, 2-hexanoyl PubChem CID: 61738 IUPAC Name: 1-(furan-2-yl)hexan-1-one SMILES: CCCCCC(=O)C1=CC=CO1
(R)-(+)-2,2'-Bis(methoxymethoxy)-1,1'-binaphthyl, 97%, Thermo Scientific Chemicals
CAS: 173831-50-0 Molecular Formula: C24H22O4 Molecular Weight (g/mol): 374.436 MDL Number: MFCD03788935 InChI Key: YIAQRNNJNMLGTP-UHFFFAOYSA-N Synonym: r-2,2'-bis methoxymethoxy-1,1'-binaphthalene,s-2,2'-bis methoxymethoxy-1,1'-binaphthalene,r-+-2,2'-bis methoxymethoxy-1,1'-binaphthyl,2,2'-bis methoxymethoxy-1,1'-binaphthalene,r-2,2'-bis methoxymethoxy-1,1'-binaphthyl,r-+-2,2'-bis methoxymethoxy-1,1'-binaphthalene,1,1'-binaphthalene, 2,2'-bis methoxymethoxy,s---2,2'-bis methoxymethoxy-1,1'-binaphthalene,s-2,2'-bis methoxymethoxy-1,1'-binaphthyl,r-2,2/'-bis methoxymethoxy-1,1/'-binaphthalene PubChem CID: 10959708 IUPAC Name: 2-(methoxymethoxy)-1-[2-(methoxymethoxy)naphthalen-1-yl]naphthalene SMILES: COCOC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=CC=CC=C43)OCOC
2,2-Difluoroacetophenone, 95%
CAS: 395-01-7 Molecular Formula: C8H6F2O Molecular Weight (g/mol): 156.132 MDL Number: MFCD06246879 InChI Key: OLYKCPDTXVZOQF-UHFFFAOYSA-N Synonym: 2,2-difluoroacetophenone,alpha,alpha-difluoroacetophenone,2,2-difluoro-1-phenyl-ethanone,2,2-difluoro-1-phenylethan-1-one,a,a-difluoroacetophenone,ethanone, 2,2-difluoro-1-phenyl,difluoromethyl phenyl ketone,difluoroacetophenone,acmc-20aojw,acetophenone, 2,2-difluoro PubChem CID: 273286 IUPAC Name: 2,2-difluoro-1-phenylethanone SMILES: C1=CC=C(C=C1)C(=O)C(F)F
7-Bromoisatin, 97%
CAS: 20780-74-9 Molecular Formula: C8H4BrNO2 Molecular Weight (g/mol): 226.029 MDL Number: MFCD00774354 InChI Key: OCVKSIWBTJCXPV-UHFFFAOYSA-N Synonym: 7-bromoisatin,7-bromoindoline-2,3-dione,7-bromo-2,3-dioxoindoline,1h-indole-2,3-dione, 7-bromo,7-bromoindole-2,3-dione,7-bromo-2,3-dihydro-1h-indole-2,3-dione,7-bromoindole-1h-2,3-dione,7-bromo-2,3-indolinedione,7-bromo isatin,7-bromo-isatin PubChem CID: 2302353 IUPAC Name: 7-bromo-1H-indole-2,3-dione SMILES: C1=CC2=C(C(=C1)Br)NC(=O)C2=O
3-Hydroxy-3-methyl-2-butanone, 90+%
CAS: 115-22-0 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.133 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
4-Bromosalicylaldehyde, 97%
CAS: 22532-62-3 Molecular Formula: C7H5BrO2 Molecular Weight (g/mol): 201.019 MDL Number: MFCD06252606 InChI Key: HXTWKHXDFATMSP-UHFFFAOYSA-N Synonym: 4-bromosalicylaldehyde,4-bromo-2-hydroxy-benzaldehyde,2-hydroxy-4-bromobenzaldehyde,benzaldehyde, 4-bromo-2-hydroxy,4-bromo-2-hydroxybenzaldheyde,4-bromosalicyladehyde,pubchem16944,acmc-1cq5t,intermediates-zcf02605,4-bromo-2-hydroxybenaldehyde PubChem CID: 4066019 IUPAC Name: 4-bromo-2-hydroxybenzaldehyde SMILES: C1=CC(=C(C=C1Br)O)C=O
1-Methylimidazole-2-carboxaldehyde, 98%
CAS: 13750-81-7 Molecular Formula: C5H6N2O Molecular Weight (g/mol): 110.12 MDL Number: MFCD01321308 InChI Key: UEBFLTZXUXZPJO-UHFFFAOYSA-N Synonym: 1-methyl-1h-imidazole-2-carbaldehyde,1-methyl-2-imidazolecarboxaldehyde,1-methylimidazole-2-carboxaldehyde,1h-imidazole-2-carboxaldehyde, 1-methyl,2-formyl-1-methylimidazole,imidazole-2-carboxaldehyde, 1-methyl,pubchem7614,zlchem 1231,2-formyl-l-methylimidazole,acmc-209ce6 PubChem CID: 139575 IUPAC Name: 1-methylimidazole-2-carbaldehyde SMILES: CN1C=CN=C1C=O
1-Phenyl-1H-pyrazole-4-carboxaldehyde, 98%
CAS: 54605-72-0 Molecular Formula: C10H8N2O Molecular Weight (g/mol): 172.19 MDL Number: MFCD02179568 InChI Key: PHVRLPFVPVKYOI-UHFFFAOYSA-N Synonym: 1-phenyl-1h-pyrazole-4-carbaldehyde,1-phenyl-1h-pyrazole-4-carboxaldehyde,1-phenylpyrazole-4-carboxaldehyde,pubchem13271,acmc-1awxu,phenyl-1h-pyrazole-4-carbaldehyde,1h-pyrazole-4-carboxaldehyde,1-phenyl PubChem CID: 952089 IUPAC Name: 1-phenylpyrazole-4-carbaldehyde SMILES: O=CC1=CN(N=C1)C1=CC=CC=C1
2-(2-Nitro-4-trifluoromethylbenzoyl)-1,3-cyclohexanedione, 95%
CAS: 104206-65-7 Molecular Formula: C14H10F3NO5 Molecular Weight (g/mol): 329.231 MDL Number: MFCD01752192 InChI Key: OUBCNLGXQFSTLU-UHFFFAOYSA-N Synonym: nitisinone,orfadin,nitisone,ntbc,2-2-nitro-4-trifluoromethyl benzoyl cyclohexane-1,3-dione,2-2-nitro-4-trifluoromethylbenzoyl-1,3-cyclohexanedione,nitisinone usan:inn,nitisinone inn,nitisinona PubChem CID: 115355 ChEBI: CHEBI:50378 IUPAC Name: 2-[2-nitro-4-(trifluoromethyl)benzoyl]cyclohexane-1,3-dione SMILES: C1CC(=O)C(C(=O)C1)C(=O)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]