
Organooxygen compounds
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(+/-)-1-Phenylethanol, 97%
CAS: 98-85-1 Molecular Formula: C8H10O Molecular Weight (g/mol): 122.167 MDL Number: MFCD00004508 InChI Key: WAPNOHKVXSQRPX-UHFFFAOYSA-N Synonym: methylphenyl carbinol,1-phenylethan-1-ol,alpha-methylbenzyl alcohol,styralyl alcohol,1-phenethyl alcohol,styrallyl alcohol,methylphenylcarbinol,1-phenylethyl alcohol,phenylmethylcarbinol,1-hydroxyethyl benzene PubChem CID: 7409 ChEBI: CHEBI:669 IUPAC Name: 1-phenylethanol SMILES: CC(C1=CC=CC=C1)O
PubChem CID | 7409 |
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CAS | 98-85-1 |
Molecular Weight (g/mol) | 122.167 |
ChEBI | CHEBI:669 |
MDL Number | MFCD00004508 |
SMILES | CC(C1=CC=CC=C1)O |
Synonym | methylphenyl carbinol,1-phenylethan-1-ol,alpha-methylbenzyl alcohol,styralyl alcohol,1-phenethyl alcohol,styrallyl alcohol,methylphenylcarbinol,1-phenylethyl alcohol,phenylmethylcarbinol,1-hydroxyethyl benzene |
IUPAC Name | 1-phenylethanol |
InChI Key | WAPNOHKVXSQRPX-UHFFFAOYSA-N |
Molecular Formula | C8H10O |
5-Chlorosalicylaldehyde, 98%
CAS: 635-93-8 Molecular Formula: C7H5ClO2 Molecular Weight (g/mol): 156.57 MDL Number: MFCD00003331 InChI Key: FUGKCSRLAQKUHG-UHFFFAOYSA-N Synonym: 5-chlorosalicylaldehyde,2-hydroxy-5-chlorobenzaldehyde,benzaldehyde, 5-chloro-2-hydroxy,4-chloro-2-formylphenol,salicylaldehyde, 5-chloro,5-chloro-2-hydroxy-benzaldehyde,unii-4gcc8zkm3o,5-chloro-salicylaldehyde,4gcc8zkm3o,5-chloro-2-hydroxy benzaldehyde PubChem CID: 12481 IUPAC Name: 5-chloro-2-hydroxybenzaldehyde SMILES: OC1=CC=C(Cl)C=C1C=O
PubChem CID | 12481 |
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CAS | 635-93-8 |
Molecular Weight (g/mol) | 156.57 |
MDL Number | MFCD00003331 |
SMILES | OC1=CC=C(Cl)C=C1C=O |
Synonym | 5-chlorosalicylaldehyde,2-hydroxy-5-chlorobenzaldehyde,benzaldehyde, 5-chloro-2-hydroxy,4-chloro-2-formylphenol,salicylaldehyde, 5-chloro,5-chloro-2-hydroxy-benzaldehyde,unii-4gcc8zkm3o,5-chloro-salicylaldehyde,4gcc8zkm3o,5-chloro-2-hydroxy benzaldehyde |
IUPAC Name | 5-chloro-2-hydroxybenzaldehyde |
InChI Key | FUGKCSRLAQKUHG-UHFFFAOYSA-N |
Molecular Formula | C7H5ClO2 |
1,3-Dichloroacetone, 96%
CAS: 534-07-6 Molecular Formula: C3H4Cl2O Molecular Weight (g/mol): 126.96 MDL Number: MFCD00000937 InChI Key: SUNMBRGCANLOEG-UHFFFAOYSA-N Synonym: 1,3-dichloroacetone,1,3-dichloro-2-propanone,1,3-dichloropropanone,s-dichloroacetone,sym-dichloroacetone,bis chloromethyl ketone,2-propanone, 1,3-dichloro,acetone, 1,3-dichloro,chloromethyl ketone PubChem CID: 10793 IUPAC Name: 1,3-dichloropropan-2-one SMILES: ClCC(=O)CCl
PubChem CID | 10793 |
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CAS | 534-07-6 |
Molecular Weight (g/mol) | 126.96 |
MDL Number | MFCD00000937 |
SMILES | ClCC(=O)CCl |
Synonym | 1,3-dichloroacetone,1,3-dichloro-2-propanone,1,3-dichloropropanone,s-dichloroacetone,sym-dichloroacetone,bis chloromethyl ketone,2-propanone, 1,3-dichloro,acetone, 1,3-dichloro,chloromethyl ketone |
IUPAC Name | 1,3-dichloropropan-2-one |
InChI Key | SUNMBRGCANLOEG-UHFFFAOYSA-N |
Molecular Formula | C3H4Cl2O |
3-Acetylpyridine, 98%
CAS: 350-03-8 Molecular Formula: C7H7NO Molecular Weight (g/mol): 121.139 MDL Number: MFCD00006396 InChI Key: WEGYGNROSJDEIW-UHFFFAOYSA-N Synonym: 3-acetylpyridine,1-pyridin-3-yl ethanone,3-acetopyridine,1-3-pyridinyl ethanone,methyl 3-pyridyl ketone,ethanone, 1-3-pyridinyl,ketone, methyl 3-pyridyl,3-acetyl pyridine,3-pyridyl methyl ketone,1-pyridin-3-yl ethan-1-one PubChem CID: 9589 IUPAC Name: 1-pyridin-3-ylethanone SMILES: CC(=O)C1=CN=CC=C1
PubChem CID | 9589 |
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CAS | 350-03-8 |
Molecular Weight (g/mol) | 121.139 |
MDL Number | MFCD00006396 |
SMILES | CC(=O)C1=CN=CC=C1 |
Synonym | 3-acetylpyridine,1-pyridin-3-yl ethanone,3-acetopyridine,1-3-pyridinyl ethanone,methyl 3-pyridyl ketone,ethanone, 1-3-pyridinyl,ketone, methyl 3-pyridyl,3-acetyl pyridine,3-pyridyl methyl ketone,1-pyridin-3-yl ethan-1-one |
IUPAC Name | 1-pyridin-3-ylethanone |
InChI Key | WEGYGNROSJDEIW-UHFFFAOYSA-N |
Molecular Formula | C7H7NO |
3-Chloro-1-propanol, 98%, stab.
CAS: 627-30-5 Molecular Formula: C3H7ClO Molecular Weight (g/mol): 94.538 MDL Number: MFCD00002943 InChI Key: LAMUXTNQCICZQX-UHFFFAOYSA-N Synonym: 3-chloro-1-propanol,3-chloropropanol,1-propanol, 3-chloro,1-chloro-3-hydroxypropane,trimethylene chlorohydrin,3-chloro-l-propanol,3-chlorpropan-1-ol,3-choro-1-propanol,1-chloro-3-propanol,3-chloropropanol-1 PubChem CID: 12313 IUPAC Name: 3-chloropropan-1-ol SMILES: C(CO)CCl
PubChem CID | 12313 |
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CAS | 627-30-5 |
Molecular Weight (g/mol) | 94.538 |
MDL Number | MFCD00002943 |
SMILES | C(CO)CCl |
Synonym | 3-chloro-1-propanol,3-chloropropanol,1-propanol, 3-chloro,1-chloro-3-hydroxypropane,trimethylene chlorohydrin,3-chloro-l-propanol,3-chlorpropan-1-ol,3-choro-1-propanol,1-chloro-3-propanol,3-chloropropanol-1 |
IUPAC Name | 3-chloropropan-1-ol |
InChI Key | LAMUXTNQCICZQX-UHFFFAOYSA-N |
Molecular Formula | C3H7ClO |
Biphenyl-4-carboxaldehyde, 98+%
CAS: 3218-36-8 Molecular Formula: C13H10O Molecular Weight (g/mol): 182.22 MDL Number: MFCD00006947 InChI Key: ISDBWOPVZKNQDW-UHFFFAOYSA-N Synonym: 4-biphenylcarboxaldehyde,4-biphenylaldehyde,p-phenylbenzaldehyde,1,1'-biphenyl-4-carbaldehyde,biphenyl-4-carboxaldehyde,4-formylbiphenyl,p-biphenylylaldehyde,1,1'-biphenyl-4-carboxaldehyde,p-biphenylaldehyde,p-biphenylcarboxaldehyde PubChem CID: 76689 IUPAC Name: 4-phenylbenzaldehyde SMILES: O=CC1=CC=C(C=C1)C1=CC=CC=C1
PubChem CID | 76689 |
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CAS | 3218-36-8 |
Molecular Weight (g/mol) | 182.22 |
MDL Number | MFCD00006947 |
SMILES | O=CC1=CC=C(C=C1)C1=CC=CC=C1 |
Synonym | 4-biphenylcarboxaldehyde,4-biphenylaldehyde,p-phenylbenzaldehyde,1,1'-biphenyl-4-carbaldehyde,biphenyl-4-carboxaldehyde,4-formylbiphenyl,p-biphenylylaldehyde,1,1'-biphenyl-4-carboxaldehyde,p-biphenylaldehyde,p-biphenylcarboxaldehyde |
IUPAC Name | 4-phenylbenzaldehyde |
InChI Key | ISDBWOPVZKNQDW-UHFFFAOYSA-N |
Molecular Formula | C13H10O |
4,4'-Diacetylbiphenyl, 98%
CAS: 787-69-9 Molecular Formula: C16H14O2 Molecular Weight (g/mol): 238.286 MDL Number: MFCD00017248 InChI Key: YSTSBXDVNKYPTR-UHFFFAOYSA-N Synonym: 4,4'-diacetylbiphenyl,4,4'-diacetyl biphenyl,1-4-4-acetylphenyl phenyl ethanone,4,4-diacetylbiphenyl,1,1'-1,1'-biphenyl-4,4'-diyl diethanone,1-4'-acetyl 1,1'-biphenyl-4-yl ethanone,ethanone, 1,1'-1,1'-biphenyl-4,4'-diylbis,1-acetyl-4-4-acetylphenyl benzene,1-4'-acetyl-1,1'-biphenyl-4-yl ethanone,diacetyl biphenyl PubChem CID: 301558 IUPAC Name: 1-[4-(4-acetylphenyl)phenyl]ethanone SMILES: CC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C
PubChem CID | 301558 |
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CAS | 787-69-9 |
Molecular Weight (g/mol) | 238.286 |
MDL Number | MFCD00017248 |
SMILES | CC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C |
Synonym | 4,4'-diacetylbiphenyl,4,4'-diacetyl biphenyl,1-4-4-acetylphenyl phenyl ethanone,4,4-diacetylbiphenyl,1,1'-1,1'-biphenyl-4,4'-diyl diethanone,1-4'-acetyl 1,1'-biphenyl-4-yl ethanone,ethanone, 1,1'-1,1'-biphenyl-4,4'-diylbis,1-acetyl-4-4-acetylphenyl benzene,1-4'-acetyl-1,1'-biphenyl-4-yl ethanone,diacetyl biphenyl |
IUPAC Name | 1-[4-(4-acetylphenyl)phenyl]ethanone |
InChI Key | YSTSBXDVNKYPTR-UHFFFAOYSA-N |
Molecular Formula | C16H14O2 |
4'-Fluoropropiophenone, 97+%
CAS: 456-03-1 Molecular Formula: C9H9FO Molecular Weight (g/mol): 152.168 MDL Number: MFCD00000356 InChI Key: QIJNVLLXIIPXQT-UHFFFAOYSA-N Synonym: 4'-fluoropropiophenone,1-4-fluorophenyl propan-1-one,p-fluoropropiophenone,4-fluoropropiophenone,ethyl 4-fluorophenyl ketone,1-propanone, 1-4-fluorophenyl,propiophenone, 4'-fluoro,para-fluoropropiophenone,1-4-fluorophenyl-1-propanone,4;-fluoropropiophenone PubChem CID: 68004 IUPAC Name: 1-(4-fluorophenyl)propan-1-one SMILES: CCC(=O)C1=CC=C(C=C1)F
PubChem CID | 68004 |
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CAS | 456-03-1 |
Molecular Weight (g/mol) | 152.168 |
MDL Number | MFCD00000356 |
SMILES | CCC(=O)C1=CC=C(C=C1)F |
Synonym | 4'-fluoropropiophenone,1-4-fluorophenyl propan-1-one,p-fluoropropiophenone,4-fluoropropiophenone,ethyl 4-fluorophenyl ketone,1-propanone, 1-4-fluorophenyl,propiophenone, 4'-fluoro,para-fluoropropiophenone,1-4-fluorophenyl-1-propanone,4;-fluoropropiophenone |
IUPAC Name | 1-(4-fluorophenyl)propan-1-one |
InChI Key | QIJNVLLXIIPXQT-UHFFFAOYSA-N |
Molecular Formula | C9H9FO |
2,4-Dibromo-3-pentanone, mixture of stereoisomers, 97%
CAS: 815-60-1 Molecular Formula: C5H8Br2O Molecular Weight (g/mol): 243.926 MDL Number: MFCD00015719 InChI Key: UOPIOAUZQKSZRO-UHFFFAOYSA-N Synonym: 2,4-dibromo-3-pentanone,2,4-dibromo-pentan-3-one,3-pentanone,2,4-dibromo,2,4-bis bromanyl pentan-3-one,2,4-dibromo-3-pentanone, mixture of stereoisomers PubChem CID: 11791395 IUPAC Name: 2,4-dibromopentan-3-one SMILES: CC(C(=O)C(C)Br)Br
PubChem CID | 11791395 |
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CAS | 815-60-1 |
Molecular Weight (g/mol) | 243.926 |
MDL Number | MFCD00015719 |
SMILES | CC(C(=O)C(C)Br)Br |
Synonym | 2,4-dibromo-3-pentanone,2,4-dibromo-pentan-3-one,3-pentanone,2,4-dibromo,2,4-bis bromanyl pentan-3-one,2,4-dibromo-3-pentanone, mixture of stereoisomers |
IUPAC Name | 2,4-dibromopentan-3-one |
InChI Key | UOPIOAUZQKSZRO-UHFFFAOYSA-N |
Molecular Formula | C5H8Br2O |
Hexanophenone, 98%
CAS: 942-92-7 Molecular Formula: C12H16O Molecular Weight (g/mol): 176.26 MDL Number: MFCD00009512 InChI Key: MAHPVQDVMLWUAG-UHFFFAOYSA-N Synonym: hexanophenone,caprophenone,1-hexanone, 1-phenyl,1-phenyl-1-hexanone,n-hexanophenone,amyl phenyl ketone,hexaphenone,pentyl phenyl ketone,4-ethylbutyrophenone,n-amylphenyl ketone PubChem CID: 70337 IUPAC Name: 1-phenylhexan-1-one SMILES: CCCCCC(=O)C1=CC=CC=C1
PubChem CID | 70337 |
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CAS | 942-92-7 |
Molecular Weight (g/mol) | 176.26 |
MDL Number | MFCD00009512 |
SMILES | CCCCCC(=O)C1=CC=CC=C1 |
Synonym | hexanophenone,caprophenone,1-hexanone, 1-phenyl,1-phenyl-1-hexanone,n-hexanophenone,amyl phenyl ketone,hexaphenone,pentyl phenyl ketone,4-ethylbutyrophenone,n-amylphenyl ketone |
IUPAC Name | 1-phenylhexan-1-one |
InChI Key | MAHPVQDVMLWUAG-UHFFFAOYSA-N |
Molecular Formula | C12H16O |
4,7-Dichloroisatin, 98%
CAS: 18711-13-2 Molecular Formula: C8H3Cl2NO2 Molecular Weight (g/mol): 216.017 MDL Number: MFCD00047214 InChI Key: NUXYYWOWNFEMNH-UHFFFAOYSA-N Synonym: 4,7-dichloroisatin,4,7-dichloroindoline-2,3-dione,4,7-dichloro isatin,4,7-dichloro-isatin,4,7-dichloro-2,3-dihydro-1h-indole-2,3-dione,1h-indole-2,3-dione, 4,7-dichloro,4,7-dichloroisatin;,4,7-dichloroisatine;,d0ek7h,isatin-based compound, 51 PubChem CID: 2734793 IUPAC Name: 4,7-dichloro-1H-indole-2,3-dione SMILES: C1=CC(=C2C(=C1Cl)C(=O)C(=O)N2)Cl
PubChem CID | 2734793 |
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CAS | 18711-13-2 |
Molecular Weight (g/mol) | 216.017 |
MDL Number | MFCD00047214 |
SMILES | C1=CC(=C2C(=C1Cl)C(=O)C(=O)N2)Cl |
Synonym | 4,7-dichloroisatin,4,7-dichloroindoline-2,3-dione,4,7-dichloro isatin,4,7-dichloro-isatin,4,7-dichloro-2,3-dihydro-1h-indole-2,3-dione,1h-indole-2,3-dione, 4,7-dichloro,4,7-dichloroisatin;,4,7-dichloroisatine;,d0ek7h,isatin-based compound, 51 |
IUPAC Name | 4,7-dichloro-1H-indole-2,3-dione |
InChI Key | NUXYYWOWNFEMNH-UHFFFAOYSA-N |
Molecular Formula | C8H3Cl2NO2 |
Trimethylacetaldehyde, 95%
CAS: 630-19-3 Molecular Formula: C5H10O Molecular Weight (g/mol): 86.13 MDL Number: MFCD00006962 InChI Key: FJJYHTVHBVXEEQ-UHFFFAOYSA-N Synonym: trimethylacetaldehyde,pivalaldehyde,pivaldehyde,propanal, 2,2-dimethyl,neopentanal,pivalic aldehyde,2,2-dimethylpropionaldehyde,unii-ssc20260qw,trimethyl acetaldehyde,trimethylacetaldehyde pivaldehyde PubChem CID: 12417 IUPAC Name: 2,2-dimethylpropanal SMILES: CC(C)(C)C=O
PubChem CID | 12417 |
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CAS | 630-19-3 |
Molecular Weight (g/mol) | 86.13 |
MDL Number | MFCD00006962 |
SMILES | CC(C)(C)C=O |
Synonym | trimethylacetaldehyde,pivalaldehyde,pivaldehyde,propanal, 2,2-dimethyl,neopentanal,pivalic aldehyde,2,2-dimethylpropionaldehyde,unii-ssc20260qw,trimethyl acetaldehyde,trimethylacetaldehyde pivaldehyde |
IUPAC Name | 2,2-dimethylpropanal |
InChI Key | FJJYHTVHBVXEEQ-UHFFFAOYSA-N |
Molecular Formula | C5H10O |
2,2'-Furil, 98%
CAS: 492-94-4 Molecular Formula: C10H6O4 Molecular Weight (g/mol): 190.154 MDL Number: MFCD00003241 InChI Key: SXPUVBFQXJHYNS-UHFFFAOYSA-N Synonym: furil,alpha-furil,bipyromucyl,2,2'-furil,bipryomucyl,di-2-furylglyoxal,difuranylglyoxal,ethanedione, di-2-furanyl,di-2-furanylethanedione,a-furil PubChem CID: 68119 IUPAC Name: 1,2-bis(furan-2-yl)ethane-1,2-dione SMILES: C1=COC(=C1)C(=O)C(=O)C2=CC=CO2
PubChem CID | 68119 |
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CAS | 492-94-4 |
Molecular Weight (g/mol) | 190.154 |
MDL Number | MFCD00003241 |
SMILES | C1=COC(=C1)C(=O)C(=O)C2=CC=CO2 |
Synonym | furil,alpha-furil,bipyromucyl,2,2'-furil,bipryomucyl,di-2-furylglyoxal,difuranylglyoxal,ethanedione, di-2-furanyl,di-2-furanylethanedione,a-furil |
IUPAC Name | 1,2-bis(furan-2-yl)ethane-1,2-dione |
InChI Key | SXPUVBFQXJHYNS-UHFFFAOYSA-N |
Molecular Formula | C10H6O4 |
4-Acetylbiphenyl, 98%
CAS: 92-91-1 Molecular Formula: C14H12O Molecular Weight (g/mol): 196.249 MDL Number: MFCD00008749 InChI Key: QCZZSANNLWPGEA-UHFFFAOYSA-N Synonym: 4-acetylbiphenyl,4'-phenylacetophenone,4-phenylacetophenone,4-biphenylyl methyl ketone,p-phenylacetophenone,p-acetylbiphenyl,1-1,1'-biphenyl-4-yl ethanone,acetophenone, 4'-phenyl,1-4-phenylphenyl ethanone,ketone, 4-biphenylyl methyl PubChem CID: 7113 IUPAC Name: 1-(4-phenylphenyl)ethanone SMILES: CC(=O)C1=CC=C(C=C1)C2=CC=CC=C2
PubChem CID | 7113 |
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CAS | 92-91-1 |
Molecular Weight (g/mol) | 196.249 |
MDL Number | MFCD00008749 |
SMILES | CC(=O)C1=CC=C(C=C1)C2=CC=CC=C2 |
Synonym | 4-acetylbiphenyl,4'-phenylacetophenone,4-phenylacetophenone,4-biphenylyl methyl ketone,p-phenylacetophenone,p-acetylbiphenyl,1-1,1'-biphenyl-4-yl ethanone,acetophenone, 4'-phenyl,1-4-phenylphenyl ethanone,ketone, 4-biphenylyl methyl |
IUPAC Name | 1-(4-phenylphenyl)ethanone |
InChI Key | QCZZSANNLWPGEA-UHFFFAOYSA-N |
Molecular Formula | C14H12O |
2-Ethoxybenzaldehyde, 97+%
CAS: 613-69-4 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00003316 InChI Key: DUVJMSPTZMCSTQ-UHFFFAOYSA-N Synonym: benzaldehyde, 2-ethoxy,o-ethoxybenzaldehyde,2-ethoxy benzaldehyde,benzaldehyde, o-ethoxy,2-ethoxy-benzaldehyde,benzaldehyde, ethoxy,ethoxy benzaldehyde,pubchem9726,ortho-ethoxybenzaldehyde,acmc-209ms1 PubChem CID: 11950 IUPAC Name: 2-ethoxybenzaldehyde SMILES: CCOC1=CC=CC=C1C=O
PubChem CID | 11950 |
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CAS | 613-69-4 |
Molecular Weight (g/mol) | 150.177 |
MDL Number | MFCD00003316 |
SMILES | CCOC1=CC=CC=C1C=O |
Synonym | benzaldehyde, 2-ethoxy,o-ethoxybenzaldehyde,2-ethoxy benzaldehyde,benzaldehyde, o-ethoxy,2-ethoxy-benzaldehyde,benzaldehyde, ethoxy,ethoxy benzaldehyde,pubchem9726,ortho-ethoxybenzaldehyde,acmc-209ms1 |
IUPAC Name | 2-ethoxybenzaldehyde |
InChI Key | DUVJMSPTZMCSTQ-UHFFFAOYSA-N |
Molecular Formula | C9H10O2 |