Organooxygen compounds
cis,cis-1,3,5-Cyclohexanetriol dihydrate, 98%, Thermo Scientific Chemicals
CAS: 60662-54-6 Molecular Formula: C6H12O3·2H2O Molecular Weight (g/mol): 168.19 InChI Key: MAPLMYMZLRIJSP-UHFFFAOYSA-N Synonym: cis,cis-1,3,5-cyclohexanetriol dihydrate,cis,cis-1,3,5-trihydroxycyclohexane,cis-phloroglucitol,1s,3s,5s-cyclohexane-1,3,5-triol dihydrate,ciscis-135-cyclohexanetrioldihydrate,cyclohexane-1,3,5-triol dihydrate,cyclohexane-1,3,5-triol-water 1/2,cis cis-1 3 5-cyclohexanetriol dihydrate,1r,3s,5s-cyclohexane-1,3,5-triol dihydrate PubChem CID: 16211857 IUPAC Name: cyclohexane-1,3,5-triol;dihydrate SMILES: C1C(CC(CC1O)O)O.O.O
Ethyl 2-oxocyclohexanecarboxylate, 95%
CAS: 1655-07-8 Molecular Formula: C9H14O3 Molecular Weight (g/mol): 170.21 MDL Number: MFCD00001631 InChI Key: FGSGHBPKHFDJOP-UHFFFAOYNA-N Synonym: ethyl 2-oxocyclohexanecarboxylate,ethyl 2-cyclohexanonecarboxylate,2-carbethoxycyclohexanone,ethyl cyclohexanone-2-carboxylate,cyclohexanecarboxylic acid, 2-oxo-, ethyl ester,2-ethoxycarbonyl cyclohexanone,2-cyclohexanonecarboxylic acid ethyl ester,2-oxocyclohexanecarboxylic acid ethyl ester,ethyl 2-oxo-1-cyclohexanecarboxylate,ethyl 2-oxocylohexanecarboxylate PubChem CID: 95543 IUPAC Name: ethyl 2-oxocyclohexane-1-carboxylate SMILES: CCOC(=O)C1CCCCC1=O
1,3-Thiazol-2-ylmethanol, 97+%, Thermo Scientific™
CAS: 14542-12-2 Molecular Formula: C4H5NOS Molecular Weight (g/mol): 115.15 MDL Number: MFCD06200855 InChI Key: JNHDLNXNYPLBMJ-UHFFFAOYSA-N Synonym: thiazol-2-ylmethanol,2-thiazolemethanol,thiazol-2-yl-methanol,2-hydroxymethylthiazole,2-hydroxymethyl thiazole,2-hydroxymehtylthiazole,1,3-thiazol-2-yl methanol,thiazol-2-yl methanol,thiazole-2-methanol,2-thiazolylmethanol PubChem CID: 2795213 SMILES: OCC1=NC=CS1
3-Ethyl-3-pentanol, 97%
CAS: 597-49-9 Molecular Formula: C7H16O Molecular Weight (g/mol): 116.20 MDL Number: MFCD00004484 InChI Key: XKIRHOWVQWCYBT-UHFFFAOYSA-N Synonym: 3-ethyl-3-pentanol,triethylcarbinol,3-pentanol, 3-ethyl,triethylmethanol,triethylmethyl alcohol,tert-heptanol,3-aethyl-pentanol-3,3-aethyl-pentanol-3 german,3-ethyl-3-hydroxypentane,ethyl-3 pentanol-3 PubChem CID: 11702 IUPAC Name: 3-ethylpentan-3-ol SMILES: CCC(O)(CC)CC
2-Hydroxymethylbenzothiazole, 98%, Thermo Scientific™
CAS: 37859-42-0 Molecular Formula: C8H7NOS Molecular Weight (g/mol): 165.21 MDL Number: MFCD00226293 InChI Key: PQXMQZYDBQBWNL-UHFFFAOYSA-N Synonym: benzo d thiazol-2-ylmethanol,2-benzothiazolemethanol,2-hydroxymethylbenzothiazole,1,3-benzothiazol-2-yl-methanol,benzothiazol-2-ylmethan-1-ol,zlchem 107,pubchem14535,benzothiazol-2-yl-methanol,chembl71700,1,3-benzothiazol-2-yl methanol PubChem CID: 268122 IUPAC Name: 1,3-benzothiazol-2-ylmethanol SMILES: OCC1=NC2=CC=CC=C2S1
(5-Methyl-1-phenyl-1H-pyrazol-4-yl)methanol, 97%, Thermo Scientific™
CAS: 153863-35-5 Molecular Formula: C11H12N2O Molecular Weight (g/mol): 188.23 MDL Number: MFCD02682046 InChI Key: JTNWKZVHKLAHTN-UHFFFAOYSA-N Synonym: 5-methyl-1-phenyl-1h-pyrazol-4-yl methanol,5-methyl-1-phenylpyrazol-4-yl methanol,1h-pyrazole-4-methanol,5-methyl-1-phenyl,acmc-1cgp6,1-phenyl-5-methyl-pyrazole-4-methanol,5-methyl-1-phenylpyrazol-4-yl methan-1-ol PubChem CID: 2776440 IUPAC Name: (5-methyl-1-phenylpyrazol-4-yl)methanol SMILES: CC1=C(CO)C=NN1C1=CC=CC=C1
2-Hydroxyisobutyric acid, 98%
CAS: 594-61-6 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.11 MDL Number: MFCD00004459 InChI Key: BWLBGMIXKSTLSX-UHFFFAOYSA-N Synonym: 2-hydroxyisobutyric acid,2-methyllactic acid,acetonic acid,2-hydroxy-2-methylpropionic acid,alpha-hydroxyisobutyric acid,hydroxydimethylacetic acid,acetonate,propanoic acid, 2-hydroxy-2-methyl,alpha-hydroxyisobutanoic acid,2-hydroxyisobutyricacid PubChem CID: 11671 ChEBI: CHEBI:50129 IUPAC Name: 2-hydroxy-2-methylpropanoic acid SMILES: CC(C)(O)C(O)=O
Lead(II) 2,4-pentanedionate
CAS: 15282-88-9 Molecular Formula: C10H14O4Pb Molecular Weight (g/mol): 405.418 MDL Number: MFCD00013499 InChI Key: UNNUWSQNTAFLDC-SYWGCQIGSA-L Synonym: lead ii acetylacetonate,2,4-pentanedione lead ii derivative PubChem CID: 53393517 IUPAC Name: bis[[(E)-4-oxopent-2-en-2-yl]oxy]lead SMILES: CC(=CC(=O)C)O[Pb]OC(=CC(=O)C)C
4-(Trifluoromethoxy)benzaldehyde, 96%
CAS: 659-28-9 Molecular Formula: C8H5F3O2 Molecular Weight (g/mol): 190.121 MDL Number: MFCD00041530 InChI Key: XQNVDQZWOBPLQZ-UHFFFAOYSA-N Synonym: 4-trifluoromethoxy benzaldehyde,p-trifluoromethoxybenzaldehyde,p-trifluoromethoxy benzaldehyde,benzaldehyde, 4-trifluoromethoxy,4-trifluoromethoxy-benzaldehyde,alpha,alpha,alpha-trifluoroanisaldehyde,pubchem1471,acmc-209nsx PubChem CID: 69573 IUPAC Name: 4-(trifluoromethoxy)benzaldehyde SMILES: C1=CC(=CC=C1C=O)OC(F)(F)F
1-Bromo-2-hexadecanone, 97%, Thermo Scientific Chemicals
CAS: 21436-52-2 Molecular Formula: C16H31BrO Molecular Weight (g/mol): 319.327 MDL Number: MFCD07777089 InChI Key: ICZYLTOWIBJLIK-UHFFFAOYSA-N Synonym: 1-bromo-2-hexadecanone,acmc-1cipg,2-hexadecanone,1-bromo PubChem CID: 14843414 IUPAC Name: 1-bromohexadecan-2-one SMILES: CCCCCCCCCCCCCCC(=O)CBr
trans-2,cis-6-Nonadienal, 90+% (major isomer), remainder mainly trans,trans-isomer
CAS: 557-48-2 Molecular Formula: C9H14O Molecular Weight (g/mol): 138.21 MDL Number: MFCD00007009 InChI Key: HZYHMHHBBBSGHB-ODYTWBPASA-N Synonym: trans-2,cis-6-nonadienal,violet leaf aldehyde,cucumber aldehyde,2e,6z-nona-2,6-dienal,2,6-nonadienal, 2e,6z,nona-2,6-dienal,e,z-2,6-nonadienal,2e,6z-nonadienal,2e,6z-nona-2,6-dien-1-al,2-trans-6-cis-nonadienal PubChem CID: 643731 ChEBI: CHEBI:7610 IUPAC Name: (2E,6Z)-nona-2,6-dienal SMILES: CCC=CCCC=CC=O
2,6-Difluoro-4-hydroxybenzaldehyde, 95%
CAS: 532967-21-8 Molecular Formula: C7H4F2O2 Molecular Weight (g/mol): 158.104 MDL Number: MFCD07772042 InChI Key: ROAQMGJHSNIROA-UHFFFAOYSA-N Synonym: 2,6-difluoro-4-hydroxy-benzaldehyde,benzaldehyde, 2,6-difluoro-4-hydroxy,ksc495q9f,3,5-difluoro-4-formylphenol,4-hydroxy-2,6-difluorobenzaldehyde,2,6-difluoro-4-hydroxy benzaldehyde,2,6-bis fluoranyl-4-oxidanyl-benzaldehyde,benzaldehyde, 2,6-difluoro-4-hydroxy-9ci PubChem CID: 24903548 IUPAC Name: 2,6-difluoro-4-hydroxybenzaldehyde SMILES: C1=C(C=C(C(=C1F)C=O)F)O
Quinoline-3-carboxaldehyde, 98+%
CAS: 13669-42-6 Molecular Formula: C10H7NO Molecular Weight (g/mol): 157.172 MDL Number: MFCD00006768 InChI Key: RYGIHSLRMNXWCN-UHFFFAOYSA-N Synonym: 3-quinolinecarboxaldehyde,quinoline-3-carboxaldehyde,3-quinolinecarbaldehyde,3-formylquinoline,quinoline-3-aldehyde,quinoline-3 carbaldehyde,rarechem ak ml 0129,3-quinoline carboxaldehyde,quinoline 3-carboxaldehyde,3-quinoline-carboxaldehyde PubChem CID: 83641 IUPAC Name: quinoline-3-carbaldehyde SMILES: C1=CC=C2C(=C1)C=C(C=N2)C=O
5'-Bromo-2'-hydroxyacetophenone, 98%
CAS: 1450-75-5 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.046 MDL Number: MFCD00191850 InChI Key: HQCCNFFIOWYINW-UHFFFAOYSA-N Synonym: 5'-bromo-2'-hydroxyacetophenone,1-5-bromo-2-hydroxyphenyl ethanone,2-acetyl-4-bromophenol,5-bromo-2-hydroxyacetophenone,2'-hydroxy-5'-bromoacetophenone,1-5-bromo-2-hydroxyphenyl ethan-1-one,ethanone, 1-5-bromo-2-hydroxyphenyl,2-hydroxy-5-bromoacetophenone,1-5-bromo-2-hydroxyphenyl-ethanon PubChem CID: 95991 IUPAC Name: 1-(5-bromo-2-hydroxyphenyl)ethanone SMILES: CC(=O)C1=C(C=CC(=C1)Br)O