Organooxygen compounds
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3-Allyloxypropionic Acid 95.0+%, TCI America™
CAS: 22577-15-7 Molecular Formula: C6H10O3 Molecular Weight (g/mol): 130.143 MDL Number: MFCD00039537 InChI Key: LBJZZFXUVYHXPH-UHFFFAOYSA-N PubChem CID: 552244 IUPAC Name: 3-prop-2-enoxypropanoic acid SMILES: C=CCOCCC(=O)O
| PubChem CID | 552244 |
|---|---|
| CAS | 22577-15-7 |
| Molecular Weight (g/mol) | 130.143 |
| MDL Number | MFCD00039537 |
| SMILES | C=CCOCCC(=O)O |
| IUPAC Name | 3-prop-2-enoxypropanoic acid |
| InChI Key | LBJZZFXUVYHXPH-UHFFFAOYSA-N |
| Molecular Formula | C6H10O3 |
2-Chloro-4'-phenylacetophenone 99.0+%, TCI America™
CAS: 635-84-7 Molecular Formula: C14H11ClO Molecular Weight (g/mol): 230.69 MDL Number: MFCD00058937 InChI Key: IQEIGQFNDLINOT-UHFFFAOYSA-N Synonym: 4-Chloroacetylbiphenyl, 4-Phenylphenacyl Chloride PubChem CID: 69463 IUPAC Name: 1-{[1,1'-biphenyl]-4-yl}-2-chloroethan-1-one SMILES: ClCC(=O)C1=CC=C(C=C1)C1=CC=CC=C1
| PubChem CID | 69463 |
|---|---|
| CAS | 635-84-7 |
| Molecular Weight (g/mol) | 230.69 |
| MDL Number | MFCD00058937 |
| SMILES | ClCC(=O)C1=CC=C(C=C1)C1=CC=CC=C1 |
| Synonym | 4-Chloroacetylbiphenyl, 4-Phenylphenacyl Chloride |
| IUPAC Name | 1-{[1,1'-biphenyl]-4-yl}-2-chloroethan-1-one |
| InChI Key | IQEIGQFNDLINOT-UHFFFAOYSA-N |
| Molecular Formula | C14H11ClO |
3,4'-Dichloropropiophenone 98.0+%, TCI America™
CAS: 3946-29-0 Molecular Formula: C9H8Cl2O Molecular Weight (g/mol): 203.06 MDL Number: MFCD00000992 InChI Key: AYFJBHFMQODYBC-UHFFFAOYSA-N Synonym: 3,4'-dichloropropiophenone,3-chloro-1-4-chlorophenyl propan-1-one,1-propanone, 3-chloro-1-4-chlorophenyl,2-chloroethyl-4-chlorophenylketone,pubchem13270,acmc-209j5n,beta,4-dichloropropiophenone,4',beta-dichloropropiophenone,3-chloro-4'-chloropropiophenone,attercop-chm at130375 PubChem CID: 77550 IUPAC Name: 3-chloro-1-(4-chlorophenyl)propan-1-one SMILES: ClCCC(=O)C1=CC=C(Cl)C=C1
| PubChem CID | 77550 |
|---|---|
| CAS | 3946-29-0 |
| Molecular Weight (g/mol) | 203.06 |
| MDL Number | MFCD00000992 |
| SMILES | ClCCC(=O)C1=CC=C(Cl)C=C1 |
| Synonym | 3,4'-dichloropropiophenone,3-chloro-1-4-chlorophenyl propan-1-one,1-propanone, 3-chloro-1-4-chlorophenyl,2-chloroethyl-4-chlorophenylketone,pubchem13270,acmc-209j5n,beta,4-dichloropropiophenone,4',beta-dichloropropiophenone,3-chloro-4'-chloropropiophenone,attercop-chm at130375 |
| IUPAC Name | 3-chloro-1-(4-chlorophenyl)propan-1-one |
| InChI Key | AYFJBHFMQODYBC-UHFFFAOYSA-N |
| Molecular Formula | C9H8Cl2O |
3-Bromo-4-ethoxybenzaldehyde 97.0+%, TCI America™
CAS: 108373-05-3 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD00672941 InChI Key: TZUUPGZANQRCHD-UHFFFAOYSA-N PubChem CID: 1494336 IUPAC Name: 3-bromo-4-ethoxybenzaldehyde SMILES: CCOC1=C(C=C(C=C1)C=O)Br
| PubChem CID | 1494336 |
|---|---|
| CAS | 108373-05-3 |
| Molecular Weight (g/mol) | 229.073 |
| MDL Number | MFCD00672941 |
| SMILES | CCOC1=C(C=C(C=C1)C=O)Br |
| IUPAC Name | 3-bromo-4-ethoxybenzaldehyde |
| InChI Key | TZUUPGZANQRCHD-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
2-(p-Toluenesulfonyl)acetophenone 98.0+%, TCI America™
CAS: 31378-03-7 Molecular Formula: C15H14O3S Molecular Weight (g/mol): 274.33 MDL Number: MFCD00026002 InChI Key: RFQXSRPFYWMUDV-UHFFFAOYSA-N PubChem CID: 97654 IUPAC Name: 2-(4-methylbenzenesulfonyl)-1-phenylethan-1-one SMILES: CC1=CC=C(C=C1)S(=O)(=O)CC(=O)C1=CC=CC=C1
| PubChem CID | 97654 |
|---|---|
| CAS | 31378-03-7 |
| Molecular Weight (g/mol) | 274.33 |
| MDL Number | MFCD00026002 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)CC(=O)C1=CC=CC=C1 |
| IUPAC Name | 2-(4-methylbenzenesulfonyl)-1-phenylethan-1-one |
| InChI Key | RFQXSRPFYWMUDV-UHFFFAOYSA-N |
| Molecular Formula | C15H14O3S |
Valeraldehyde 95.0+%, TCI America™
CAS: 110-62-3 Molecular Formula: C5H10O Molecular Weight (g/mol): 86.13 MDL Number: MFCD00007026 InChI Key: HGBOYTHUEUWSSQ-UHFFFAOYSA-N Synonym: valeraldehyde,n-pentanal,n-valeraldehyde,valeric aldehyde,valeral,valeryl aldehyde,amylaldehyde,butyl formal,amyl aldehyde,valeric acid aldehyde PubChem CID: 8063 ChEBI: CHEBI:84069 IUPAC Name: pentanal SMILES: CCCCC=O
| PubChem CID | 8063 |
|---|---|
| CAS | 110-62-3 |
| Molecular Weight (g/mol) | 86.13 |
| ChEBI | CHEBI:84069 |
| MDL Number | MFCD00007026 |
| SMILES | CCCCC=O |
| Synonym | valeraldehyde,n-pentanal,n-valeraldehyde,valeric aldehyde,valeral,valeryl aldehyde,amylaldehyde,butyl formal,amyl aldehyde,valeric acid aldehyde |
| IUPAC Name | pentanal |
| InChI Key | HGBOYTHUEUWSSQ-UHFFFAOYSA-N |
| Molecular Formula | C5H10O |
4'-Nitrobenzo-18-crown 6-Ether 97.0+%, TCI America™
CAS: 53408-96-1 Molecular Formula: C16H23NO8 Molecular Weight (g/mol): 357.359 MDL Number: MFCD00143207 InChI Key: LQXOKBZWNFJJGI-UHFFFAOYSA-N Synonym: 4-nitrobenzo-18-crown-6,4'-nitrobenzo-18-crown 6-ether,nitrobenzo-18-crown-6,18-nitro-2,3,5,6,8,9,11,12,14,15-decahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecine,20-nitro-2,5,8,11,14,17-hexaoxabicyclo 16.4.0 docosa-1 18 ,19,21-triene,4'-nitrobenzo-18-crown-6,lqxokbzwnfjjgi-uhfffaoysa,2,3-4-nitrobenzo-1,4,7,10,13,16-hexaoxacycloocta,2,3-4-nitrobenzo-1,4,7,10,13,16-hexaoxacyclooctadec-2-ene PubChem CID: 602198 IUPAC Name: 20-nitro-2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-triene SMILES: C1COCCOCCOC2=C(C=CC(=C2)[N+](=O)[O-])OCCOCCO1
| PubChem CID | 602198 |
|---|---|
| CAS | 53408-96-1 |
| Molecular Weight (g/mol) | 357.359 |
| MDL Number | MFCD00143207 |
| SMILES | C1COCCOCCOC2=C(C=CC(=C2)[N+](=O)[O-])OCCOCCO1 |
| Synonym | 4-nitrobenzo-18-crown-6,4'-nitrobenzo-18-crown 6-ether,nitrobenzo-18-crown-6,18-nitro-2,3,5,6,8,9,11,12,14,15-decahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecine,20-nitro-2,5,8,11,14,17-hexaoxabicyclo 16.4.0 docosa-1 18 ,19,21-triene,4'-nitrobenzo-18-crown-6,lqxokbzwnfjjgi-uhfffaoysa,2,3-4-nitrobenzo-1,4,7,10,13,16-hexaoxacycloocta,2,3-4-nitrobenzo-1,4,7,10,13,16-hexaoxacyclooctadec-2-ene |
| IUPAC Name | 20-nitro-2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-triene |
| InChI Key | LQXOKBZWNFJJGI-UHFFFAOYSA-N |
| Molecular Formula | C16H23NO8 |
(R)-(+)-3-Chloro-1-phenyl-1-propanol 98.0+%, TCI America™
CAS: 100306-33-0 Molecular Formula: C9H11ClO Molecular Weight (g/mol): 170.636 MDL Number: MFCD00075128 InChI Key: JZFUHAGLMZWKTF-SECBINFHSA-N Synonym: r-3-chloro-1-phenylpropan-1-ol,r-+-3-chloro-1-phenyl-1-propanol,r-+-3-chloro-1-phenylpropanol,1r-3-chloro-1-phenylpropan-1-ol,1r-3-chloro-1-phenyl-propan-1-ol,r-3-chloro-1-phenyl-1-propanol,r-3-chloro-1-phenyl-propan-1-ol,r-3-chloro-1-phenylpropanol,pubchem5738 PubChem CID: 642409 IUPAC Name: (1R)-3-chloro-1-phenylpropan-1-ol SMILES: C1=CC=C(C=C1)C(CCCl)O
| PubChem CID | 642409 |
|---|---|
| CAS | 100306-33-0 |
| Molecular Weight (g/mol) | 170.636 |
| MDL Number | MFCD00075128 |
| SMILES | C1=CC=C(C=C1)C(CCCl)O |
| Synonym | r-3-chloro-1-phenylpropan-1-ol,r-+-3-chloro-1-phenyl-1-propanol,r-+-3-chloro-1-phenylpropanol,1r-3-chloro-1-phenylpropan-1-ol,1r-3-chloro-1-phenyl-propan-1-ol,r-3-chloro-1-phenyl-1-propanol,r-3-chloro-1-phenyl-propan-1-ol,r-3-chloro-1-phenylpropanol,pubchem5738 |
| IUPAC Name | (1R)-3-chloro-1-phenylpropan-1-ol |
| InChI Key | JZFUHAGLMZWKTF-SECBINFHSA-N |
| Molecular Formula | C9H11ClO |
alpha-Cyclopropylbenzyl Alcohol 96.0+%, TCI America™
CAS: 1007-03-0 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.205 MDL Number: MFCD00001299 InChI Key: GOXKCYOMDINCCD-UHFFFAOYSA-N Synonym: cyclopropyl phenyl methanol,alpha-cyclopropylbenzyl alcohol,cyclopropylphenylcarbinol,cyclopropyl phenylmethanol,cyclopropyl phenyl carbinol,phenylcyclopropyl methanol,acmc-2097rv,cyclopropylphenylmethan-1-ol,alpha-cyclopropylbenzylalcohol,cyclopropyl phenyl methanol # PubChem CID: 66090 IUPAC Name: cyclopropyl(phenyl)methanol SMILES: C1CC1C(C2=CC=CC=C2)O
| PubChem CID | 66090 |
|---|---|
| CAS | 1007-03-0 |
| Molecular Weight (g/mol) | 148.205 |
| MDL Number | MFCD00001299 |
| SMILES | C1CC1C(C2=CC=CC=C2)O |
| Synonym | cyclopropyl phenyl methanol,alpha-cyclopropylbenzyl alcohol,cyclopropylphenylcarbinol,cyclopropyl phenylmethanol,cyclopropyl phenyl carbinol,phenylcyclopropyl methanol,acmc-2097rv,cyclopropylphenylmethan-1-ol,alpha-cyclopropylbenzylalcohol,cyclopropyl phenyl methanol # |
| IUPAC Name | cyclopropyl(phenyl)methanol |
| InChI Key | GOXKCYOMDINCCD-UHFFFAOYSA-N |
| Molecular Formula | C10H12O |
6-Chloroisatin 98.0+%, TCI America™
CAS: 6341-92-0 Molecular Formula: C8H4ClNO2 Molecular Weight (g/mol): 181.575 InChI Key: RVXLBLSGEPQBIO-UHFFFAOYSA-N Synonym: 6-Chloroindole-2,3-dione, 6-Chloro-2,3-indolinedione PubChem CID: 241331 IUPAC Name: 6-chloro-1H-indole-2,3-dione SMILES: C1=CC2=C(C=C1Cl)NC(=O)C2=O
| PubChem CID | 241331 |
|---|---|
| CAS | 6341-92-0 |
| Molecular Weight (g/mol) | 181.575 |
| SMILES | C1=CC2=C(C=C1Cl)NC(=O)C2=O |
| Synonym | 6-Chloroindole-2,3-dione, 6-Chloro-2,3-indolinedione |
| IUPAC Name | 6-chloro-1H-indole-2,3-dione |
| InChI Key | RVXLBLSGEPQBIO-UHFFFAOYSA-N |
| Molecular Formula | C8H4ClNO2 |
2'-Hydroxypropiophenone 97.0+%, TCI America™
CAS: 610-99-1 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00002220 InChI Key: KDUWXMIHHIVXER-UHFFFAOYSA-N Synonym: 2'-hydroxypropiophenone,1-2-hydroxyphenyl propan-1-one,2-propionylphenol,1-propanone, 1-2-hydroxyphenyl,o-hydroxypropiophenone,o-propiophenol,propiophenone, 2'-hydroxy,ortho-hydroxypropiophenone,1-propanone,1-2-hydroxyphenyl,2-hydroxypropiophenone PubChem CID: 69133 IUPAC Name: 1-(2-hydroxyphenyl)propan-1-one SMILES: CCC(=O)C1=CC=CC=C1O
| PubChem CID | 69133 |
|---|---|
| CAS | 610-99-1 |
| Molecular Weight (g/mol) | 150.177 |
| MDL Number | MFCD00002220 |
| SMILES | CCC(=O)C1=CC=CC=C1O |
| Synonym | 2'-hydroxypropiophenone,1-2-hydroxyphenyl propan-1-one,2-propionylphenol,1-propanone, 1-2-hydroxyphenyl,o-hydroxypropiophenone,o-propiophenol,propiophenone, 2'-hydroxy,ortho-hydroxypropiophenone,1-propanone,1-2-hydroxyphenyl,2-hydroxypropiophenone |
| IUPAC Name | 1-(2-hydroxyphenyl)propan-1-one |
| InChI Key | KDUWXMIHHIVXER-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
2,5-Dimethyl-3-hexyne-2,5-diol 99.0+%, TCI America™
CAS: 142-30-3 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.198 MDL Number: MFCD00004468 InChI Key: IHJUECRFYCQBMW-UHFFFAOYSA-N Synonym: 2,5-dimethyl-3-hexyne-2,5-diol,dimethylhexynediol,kemitracin-50,tetramethylbutynediol,acetylenepinacol,3-hexyne-2,5-diol, 2,5-dimethyl,olfine y,tetramethyl-2-butynediol,unii-22rr53u71w,2,5-dimethylhexyne-2,5-diol PubChem CID: 8883 IUPAC Name: 2,5-dimethylhex-3-yne-2,5-diol SMILES: CC(C)(C#CC(C)(C)O)O
| PubChem CID | 8883 |
|---|---|
| CAS | 142-30-3 |
| Molecular Weight (g/mol) | 142.198 |
| MDL Number | MFCD00004468 |
| SMILES | CC(C)(C#CC(C)(C)O)O |
| Synonym | 2,5-dimethyl-3-hexyne-2,5-diol,dimethylhexynediol,kemitracin-50,tetramethylbutynediol,acetylenepinacol,3-hexyne-2,5-diol, 2,5-dimethyl,olfine y,tetramethyl-2-butynediol,unii-22rr53u71w,2,5-dimethylhexyne-2,5-diol |
| IUPAC Name | 2,5-dimethylhex-3-yne-2,5-diol |
| InChI Key | IHJUECRFYCQBMW-UHFFFAOYSA-N |
| Molecular Formula | C8H14O2 |
2-Acetyl-7-methoxybenzofuran 98.0+%, TCI America™
CAS: 43071-52-9 Molecular Formula: C11H10O3 Molecular Weight (g/mol): 190.198 MDL Number: MFCD00016911 InChI Key: MUUMFANQVPWPFY-UHFFFAOYSA-N Synonym: 2-acetyl-7-methoxybenzofuran,1-7-methoxybenzofuran-2-yl ethanone,ethanone, 1-7-methoxy-2-benzofuranyl,1-7-methoxy-1-benzofuran-2-yl ethanone,2-acetyl-7-methoxybenzo b furan,2-acetyl-7-methoxycoumarone,7-methoxy-2-benzofuranyl methyl ketone,ketone, 7-methoxy-2-benzofuranyl methyl,1-7-methoxy-2-benzofuranyl ethanone,1-7-methoxy-1-benzofuran-2-yl ethan-1-one PubChem CID: 39378 IUPAC Name: 1-(7-methoxy-1-benzofuran-2-yl)ethanone SMILES: CC(=O)C1=CC2=C(O1)C(=CC=C2)OC
| PubChem CID | 39378 |
|---|---|
| CAS | 43071-52-9 |
| Molecular Weight (g/mol) | 190.198 |
| MDL Number | MFCD00016911 |
| SMILES | CC(=O)C1=CC2=C(O1)C(=CC=C2)OC |
| Synonym | 2-acetyl-7-methoxybenzofuran,1-7-methoxybenzofuran-2-yl ethanone,ethanone, 1-7-methoxy-2-benzofuranyl,1-7-methoxy-1-benzofuran-2-yl ethanone,2-acetyl-7-methoxybenzo b furan,2-acetyl-7-methoxycoumarone,7-methoxy-2-benzofuranyl methyl ketone,ketone, 7-methoxy-2-benzofuranyl methyl,1-7-methoxy-2-benzofuranyl ethanone,1-7-methoxy-1-benzofuran-2-yl ethan-1-one |
| IUPAC Name | 1-(7-methoxy-1-benzofuran-2-yl)ethanone |
| InChI Key | MUUMFANQVPWPFY-UHFFFAOYSA-N |
| Molecular Formula | C11H10O3 |
2-Benzyloxybenzaldehyde 98.0+%, TCI America™
CAS: 5896-17-3 Molecular Formula: C14H12O2 Molecular Weight (g/mol): 212.25 MDL Number: MFCD00016583 InChI Key: PBEJTRAJWCNHRS-UHFFFAOYSA-N Synonym: 2-benzyloxy benzaldehyde,2-benzyloxybenzaldehyde,benzaldehyde, 2-phenylmethoxy,o-benzyloxy benzaldehyde,benzaldehyde, o-benzyloxy,o-benzylsalicylaldehyde,2-benzyl-oxy benzaldehyde,2-phenylmethoxy benzaldehyde,benzyloxybenzaldehyde,o-benzyloxybenzaldehyde PubChem CID: 344784 IUPAC Name: 2-(benzyloxy)benzaldehyde SMILES: O=CC1=CC=CC=C1OCC1=CC=CC=C1
| PubChem CID | 344784 |
|---|---|
| CAS | 5896-17-3 |
| Molecular Weight (g/mol) | 212.25 |
| MDL Number | MFCD00016583 |
| SMILES | O=CC1=CC=CC=C1OCC1=CC=CC=C1 |
| Synonym | 2-benzyloxy benzaldehyde,2-benzyloxybenzaldehyde,benzaldehyde, 2-phenylmethoxy,o-benzyloxy benzaldehyde,benzaldehyde, o-benzyloxy,o-benzylsalicylaldehyde,2-benzyl-oxy benzaldehyde,2-phenylmethoxy benzaldehyde,benzyloxybenzaldehyde,o-benzyloxybenzaldehyde |
| IUPAC Name | 2-(benzyloxy)benzaldehyde |
| InChI Key | PBEJTRAJWCNHRS-UHFFFAOYSA-N |
| Molecular Formula | C14H12O2 |