
Organooxygen compounds
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Malonic acid, 99%, MP Biomedicals™
CAS: 141-82-2 Molecular Formula: C3H4O4 Molecular Weight (g/mol): 104.061 InChI Key: OFOBLEOULBTSOW-UHFFFAOYSA-N Synonym: malonic acid,dicarboxymethane,carboxyacetic acid,methanedicarboxylic acid,kyselina malonova,usaf ek-695,dicarboxylate,dicarboxylic acid,kyselina malonova czech,propanediolic acid PubChem CID: 867 ChEBI: CHEBI:30794 IUPAC Name: propanedioic acid SMILES: C(C(=O)O)C(=O)O
PubChem CID | 867 |
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CAS | 141-82-2 |
Molecular Weight (g/mol) | 104.061 |
ChEBI | CHEBI:30794 |
SMILES | C(C(=O)O)C(=O)O |
Synonym | malonic acid,dicarboxymethane,carboxyacetic acid,methanedicarboxylic acid,kyselina malonova,usaf ek-695,dicarboxylate,dicarboxylic acid,kyselina malonova czech,propanediolic acid |
IUPAC Name | propanedioic acid |
InChI Key | OFOBLEOULBTSOW-UHFFFAOYSA-N |
Molecular Formula | C3H4O4 |
Shikimic Acid, ≥98%, MP Biomedicals™
CAS: 138-59-0 Molecular Formula: C7H9O5- Molecular Weight (g/mol): 173.144 MDL Number: MFCD00066278 InChI Key: JXOHGGNKMLTUBP-HSUXUTPPSA-M Synonym: shikimic acid,shikimate,--shikimic acid,l-shikimic acid,3r,4s,5r-3,4,5-trihydroxycyclohex-1-enecarboxylic acid,3r,4s,5r-3,4,5-trihydroxycyclohex-1-ene-1-carboxylic acid,--shikimate,ccris 7681,unii-29ms2wi2nu,3alpha,4alpha,5beta-trihydroxy-1-cyclohexene-1-carboxylic acid PubChem CID: 7057976 ChEBI: CHEBI:36208 IUPAC Name: (3R,4S,5R)-3,4,5-trihydroxycyclohexene-1-carboxylate SMILES: C1C(C(C(C=C1C(=O)[O-])O)O)O
PubChem CID | 7057976 |
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CAS | 138-59-0 |
Molecular Weight (g/mol) | 173.144 |
ChEBI | CHEBI:36208 |
MDL Number | MFCD00066278 |
SMILES | C1C(C(C(C=C1C(=O)[O-])O)O)O |
Synonym | shikimic acid,shikimate,--shikimic acid,l-shikimic acid,3r,4s,5r-3,4,5-trihydroxycyclohex-1-enecarboxylic acid,3r,4s,5r-3,4,5-trihydroxycyclohex-1-ene-1-carboxylic acid,--shikimate,ccris 7681,unii-29ms2wi2nu,3alpha,4alpha,5beta-trihydroxy-1-cyclohexene-1-carboxylic acid |
IUPAC Name | (3R,4S,5R)-3,4,5-trihydroxycyclohexene-1-carboxylate |
InChI Key | JXOHGGNKMLTUBP-HSUXUTPPSA-M |
Molecular Formula | C7H9O5- |
1-(3,5-Difluoro-2-hydroxyphenyl)ethan-1-one, Thermo Scientific™
CAS: 140675-42-9 Molecular Formula: C8H6F2O2 Molecular Weight (g/mol): 172.131 MDL Number: MFCD00042476 InChI Key: MCDJUVXLLXTCFP-UHFFFAOYSA-N Synonym: 1-3,5-difluoro-2-hydroxyphenyl ethanone,1-3,5-difluoro-2-hydroxyphenyl ethan-1-one,3',5'-difluoro-2'-hydroxyacetophenone,3,5-difluoro-2-hydroxyacetophenone,2-acetyl-4,6-difluorophenol,ethanone,1-3,5-difluoro-2-hydroxyphenyl,1-acetyl-3,5-difluoro-2-hydroxybenzene,acmc-1byqa,1-3,5-difluoro-2-hydroxyphenyl-ethanone,1-3,5-difluoro-2-hydroxy-phenyl-ethanone PubChem CID: 2736976 IUPAC Name: 1-(3,5-difluoro-2-hydroxyphenyl)ethanone SMILES: CC(=O)C1=CC(=CC(=C1O)F)F
PubChem CID | 2736976 |
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CAS | 140675-42-9 |
Molecular Weight (g/mol) | 172.131 |
MDL Number | MFCD00042476 |
SMILES | CC(=O)C1=CC(=CC(=C1O)F)F |
Synonym | 1-3,5-difluoro-2-hydroxyphenyl ethanone,1-3,5-difluoro-2-hydroxyphenyl ethan-1-one,3',5'-difluoro-2'-hydroxyacetophenone,3,5-difluoro-2-hydroxyacetophenone,2-acetyl-4,6-difluorophenol,ethanone,1-3,5-difluoro-2-hydroxyphenyl,1-acetyl-3,5-difluoro-2-hydroxybenzene,acmc-1byqa,1-3,5-difluoro-2-hydroxyphenyl-ethanone,1-3,5-difluoro-2-hydroxy-phenyl-ethanone |
IUPAC Name | 1-(3,5-difluoro-2-hydroxyphenyl)ethanone |
InChI Key | MCDJUVXLLXTCFP-UHFFFAOYSA-N |
Molecular Formula | C8H6F2O2 |
2-Bromo-1-(4-pentylphenyl)ethan-1-one, 95%, Thermo Scientific™
CAS: 64328-68-3 Molecular Formula: C13H17BrO Molecular Weight (g/mol): 269.182 MDL Number: MFCD00218837 InChI Key: AVYNDJWQMUOSJZ-UHFFFAOYSA-N Synonym: 2-bromo-1-4-pentylphenyl ethan-1-one,2-bromo-1-4-pentylphenyl ethanone,2-bromo-4'-pent-1-yl acetophenone,ethanone,2-bromo-1-4-pentylphenyl,2-bromo-1-4-pent-1-yl phenyl ethan-1-one PubChem CID: 2775670 IUPAC Name: 2-bromo-1-(4-pentylphenyl)ethanone SMILES: CCCCCC1=CC=C(C=C1)C(=O)CBr
PubChem CID | 2775670 |
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CAS | 64328-68-3 |
Molecular Weight (g/mol) | 269.182 |
MDL Number | MFCD00218837 |
SMILES | CCCCCC1=CC=C(C=C1)C(=O)CBr |
Synonym | 2-bromo-1-4-pentylphenyl ethan-1-one,2-bromo-1-4-pentylphenyl ethanone,2-bromo-4'-pent-1-yl acetophenone,ethanone,2-bromo-1-4-pentylphenyl,2-bromo-1-4-pent-1-yl phenyl ethan-1-one |
IUPAC Name | 2-bromo-1-(4-pentylphenyl)ethanone |
InChI Key | AVYNDJWQMUOSJZ-UHFFFAOYSA-N |
Molecular Formula | C13H17BrO |
2-Hydroxybicyclo[3.2.1]octane-6-carboxylic acid, 97%, Thermo Scientific™
CAS: 257932-29-9 Molecular Formula: C9H14O3 Molecular Weight (g/mol): 170.21 MDL Number: MFCD00180256 InChI Key: FSQSHXLJRFYYMV-UHFFFAOYNA-N Synonym: 2-hydroxybicyclo 3.2.1 octane-6-carboxylic acid,maybridge1_002398,4-hydroxybicyclo 3.2.1 octane-7-carboxylic acid,bicyclo 3.2.1 octane-6-carboxylicacid, 2-hydroxy PubChem CID: 2802922 IUPAC Name: 4-hydroxybicyclo[3.2.1]octane-7-carboxylic acid SMILES: OC1CCC2CC1CC2C(O)=O
PubChem CID | 2802922 |
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CAS | 257932-29-9 |
Molecular Weight (g/mol) | 170.21 |
MDL Number | MFCD00180256 |
SMILES | OC1CCC2CC1CC2C(O)=O |
Synonym | 2-hydroxybicyclo 3.2.1 octane-6-carboxylic acid,maybridge1_002398,4-hydroxybicyclo 3.2.1 octane-7-carboxylic acid,bicyclo 3.2.1 octane-6-carboxylicacid, 2-hydroxy |
IUPAC Name | 4-hydroxybicyclo[3.2.1]octane-7-carboxylic acid |
InChI Key | FSQSHXLJRFYYMV-UHFFFAOYNA-N |
Molecular Formula | C9H14O3 |
Phenylethyl Alcohol, 98%, Spectrum™ Chemical
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CAS: 60-12-8
CAS | 60-12-8 |
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Cholesterol, NF, 95-102%, Spectrum™ Chemical
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CAS: 57-88-5 Molecular Formula: C27H46O Molecular Weight (g/mol): 386.66 InChI Key: HVYWMOMLDIMFJA-DPAQBDIFSA-N IUPAC Name: (1R,3aS,3bS,7S,9aR,9bS,11aR)-9a,11a-dimethyl-1-[(2R)-6-methylheptan-2-yl]-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-ol SMILES: CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
CAS | 57-88-5 |
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Molecular Weight (g/mol) | 386.66 |
SMILES | CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |
IUPAC Name | (1R,3aS,3bS,7S,9aR,9bS,11aR)-9a,11a-dimethyl-1-[(2R)-6-methylheptan-2-yl]-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-ol |
InChI Key | HVYWMOMLDIMFJA-DPAQBDIFSA-N |
Molecular Formula | C27H46O |
Ethyl Vanillin, NF, 98-101%, Spectrum™ Chemical
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CAS: 121-32-4 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00006944 InChI Key: CBOQJANXLMLOSS-UHFFFAOYSA-N IUPAC Name: 3-ethoxy-4-hydroxybenzaldehyde SMILES: CCOC1=CC(C=O)=CC=C1O
CAS | 121-32-4 |
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Molecular Weight (g/mol) | 166.18 |
MDL Number | MFCD00006944 |
SMILES | CCOC1=CC(C=O)=CC=C1O |
IUPAC Name | 3-ethoxy-4-hydroxybenzaldehyde |
InChI Key | CBOQJANXLMLOSS-UHFFFAOYSA-N |
Molecular Formula | C9H10O3 |
2,4-Pentanedione, Reagent, 99%, Spectrum™ Chemical
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CAS: 123-54-6 Molecular Formula: C5H8O2 Molecular Weight (g/mol): 100.12 MDL Number: MFCD00008787 InChI Key: YRKCREAYFQTBPV-UHFFFAOYSA-N IUPAC Name: pentane-2,4-dione SMILES: CC(=O)CC(C)=O
CAS | 123-54-6 |
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Molecular Weight (g/mol) | 100.12 |
MDL Number | MFCD00008787 |
SMILES | CC(=O)CC(C)=O |
IUPAC Name | pentane-2,4-dione |
InChI Key | YRKCREAYFQTBPV-UHFFFAOYSA-N |
Molecular Formula | C5H8O2 |
Ascorbyl Palmitate, FCC, 95%, Spectrum™ Chemical
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CAS: 137-66-6 Molecular Formula: C22H38O7 Molecular Weight (g/mol): 414.54 MDL Number: MFCD00005377 InChI Key: NULLRXHRYOXSEW-UHFFFAOYNA-N IUPAC Name: 2-(4,5-dihydroxy-3-oxo-2,3-dihydrofuran-2-yl)-2-hydroxyethyl hexadecanoate SMILES: CCCCCCCCCCCCCCCC(=O)OCC(O)C1OC(O)=C(O)C1=O
CAS | 137-66-6 |
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Molecular Weight (g/mol) | 414.54 |
MDL Number | MFCD00005377 |
SMILES | CCCCCCCCCCCCCCCC(=O)OCC(O)C1OC(O)=C(O)C1=O |
IUPAC Name | 2-(4,5-dihydroxy-3-oxo-2,3-dihydrofuran-2-yl)-2-hydroxyethyl hexadecanoate |
InChI Key | NULLRXHRYOXSEW-UHFFFAOYNA-N |
Molecular Formula | C22H38O7 |
Bupropion Hydrochloride, USP, 98-102%, Spectrum™ Chemical
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CAS: 31677-93-7 Molecular Formula: C13H19Cl2NO Molecular Weight (g/mol): 276.20 InChI Key: HEYVINCGKDONRU-UHFFFAOYNA-N IUPAC Name: hydrogen 2-(tert-butylamino)-1-(3-chlorophenyl)propan-1-one chloride SMILES: [H+].[Cl-].CC(NC(C)(C)C)C(=O)C1=CC=CC(Cl)=C1
CAS | 31677-93-7 |
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Molecular Weight (g/mol) | 276.20 |
SMILES | [H+].[Cl-].CC(NC(C)(C)C)C(=O)C1=CC=CC(Cl)=C1 |
IUPAC Name | hydrogen 2-(tert-butylamino)-1-(3-chlorophenyl)propan-1-one chloride |
InChI Key | HEYVINCGKDONRU-UHFFFAOYNA-N |
Molecular Formula | C13H19Cl2NO |
Pregnenolone, 98%, Spectrum™ Chemical
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CAS: 145-13-1
CAS | 145-13-1 |
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Propionaldehyde, 97%, Spectrum™ Chemical
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CAS: 123-38-6
CAS | 123-38-6 |
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Trimethyl Orthoformate, 99%, Spectrum™ Chemical
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CAS: 149-73-5
CAS | 149-73-5 |
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1-Pentanol, Reagent, ACS, 98%, Spectrum™ Chemical
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CAS: 71-41-0 Molecular Formula: C5H12O Molecular Weight (g/mol): 88.15 MDL Number: MFCD00002977,MFCD00081734,MFCD01075169 InChI Key: AMQJEAYHLZJPGS-UHFFFAOYSA-N IUPAC Name: pentan-1-ol SMILES: CCCCCO
CAS | 71-41-0 |
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Molecular Weight (g/mol) | 88.15 |
MDL Number | MFCD00002977,MFCD00081734,MFCD01075169 |
SMILES | CCCCCO |
IUPAC Name | pentan-1-ol |
InChI Key | AMQJEAYHLZJPGS-UHFFFAOYSA-N |
Molecular Formula | C5H12O |