Organooxygen compounds
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3,3-Dimethylbutyraldehyde, 97%
CAS: 2987-16-8 Molecular Formula: C6H12O Molecular Weight (g/mol): 100.161 MDL Number: MFCD00042807 InChI Key: LTNUSYNQZJZUSY-UHFFFAOYSA-N Synonym: 3,3-dimethylbutyraldehyde,3,3-dimethyl-butyraldehyde,butanal, 3,3-dimethyl,unii-cam6hd7jki,tert-butylacetaldehyde,3,3-dimethyl-butanal,cam6hd7jki,neohexal,pubchem3076,3,3-dimethylbutyraldehyd PubChem CID: 76335 IUPAC Name: 3,3-dimethylbutanal SMILES: CC(C)(C)CC=O
| PubChem CID | 76335 |
|---|---|
| CAS | 2987-16-8 |
| Molecular Weight (g/mol) | 100.161 |
| MDL Number | MFCD00042807 |
| SMILES | CC(C)(C)CC=O |
| Synonym | 3,3-dimethylbutyraldehyde,3,3-dimethyl-butyraldehyde,butanal, 3,3-dimethyl,unii-cam6hd7jki,tert-butylacetaldehyde,3,3-dimethyl-butanal,cam6hd7jki,neohexal,pubchem3076,3,3-dimethylbutyraldehyd |
| IUPAC Name | 3,3-dimethylbutanal |
| InChI Key | LTNUSYNQZJZUSY-UHFFFAOYSA-N |
| Molecular Formula | C6H12O |
4-Bromothiophene-2-carboxaldehyde, 96%
CAS: 18791-75-8 Molecular Formula: C5H3BrOS Molecular Weight (g/mol): 191.04 MDL Number: MFCD00005431 InChI Key: PDONIKHDXYHTLS-UHFFFAOYSA-N Synonym: 4-bromothiophene-2-carboxaldehyde,4-bromo-2-thiophenecarboxaldehyde,4-bromo-2-formylthiophene,4-bromo-2-thiophenecarbaldehyde,4-bromo-thiophene-2-carbaldehyde,4-bromo-2-thiophene carboxaldehyde,4-bromothiophen-2-carboxaldehyde,2-thiophenecarboxaldehyde, 4-bromo,4-bromothiophene-2-aldehyde,3-bromothiophene-5-carboxaldehyde PubChem CID: 87792 IUPAC Name: 4-bromothiophene-2-carbaldehyde SMILES: BrC1=CSC(C=O)=C1
| PubChem CID | 87792 |
|---|---|
| CAS | 18791-75-8 |
| Molecular Weight (g/mol) | 191.04 |
| MDL Number | MFCD00005431 |
| SMILES | BrC1=CSC(C=O)=C1 |
| Synonym | 4-bromothiophene-2-carboxaldehyde,4-bromo-2-thiophenecarboxaldehyde,4-bromo-2-formylthiophene,4-bromo-2-thiophenecarbaldehyde,4-bromo-thiophene-2-carbaldehyde,4-bromo-2-thiophene carboxaldehyde,4-bromothiophen-2-carboxaldehyde,2-thiophenecarboxaldehyde, 4-bromo,4-bromothiophene-2-aldehyde,3-bromothiophene-5-carboxaldehyde |
| IUPAC Name | 4-bromothiophene-2-carbaldehyde |
| InChI Key | PDONIKHDXYHTLS-UHFFFAOYSA-N |
| Molecular Formula | C5H3BrOS |
3-Fluoropyridine-2-carboxaldehyde, 98%
CAS: 31224-43-8 Molecular Formula: C6H4FNO Molecular Weight (g/mol): 125.102 MDL Number: MFCD07781234 InChI Key: OZIMPUNGBUYCSP-UHFFFAOYSA-N Synonym: 3-fluoro-2-formylpyridine,3-fluoropicolinaldehyde,3-fluoro-2-pyridinecarboxaldehyde,3-fluoropyridine-2-carboxaldehyde,3-fluoro-pyridine-2-carbaldehyde,2-pyridinecarboxaldehyde, 3-fluoro,2-formyl-3-fluoropyridine,pubchem5142,acmc-209hkw,3-fluoro-2-formyl-pyridine PubChem CID: 11344017 IUPAC Name: 3-fluoropyridine-2-carbaldehyde SMILES: C1=CC(=C(N=C1)C=O)F
| PubChem CID | 11344017 |
|---|---|
| CAS | 31224-43-8 |
| Molecular Weight (g/mol) | 125.102 |
| MDL Number | MFCD07781234 |
| SMILES | C1=CC(=C(N=C1)C=O)F |
| Synonym | 3-fluoro-2-formylpyridine,3-fluoropicolinaldehyde,3-fluoro-2-pyridinecarboxaldehyde,3-fluoropyridine-2-carboxaldehyde,3-fluoro-pyridine-2-carbaldehyde,2-pyridinecarboxaldehyde, 3-fluoro,2-formyl-3-fluoropyridine,pubchem5142,acmc-209hkw,3-fluoro-2-formyl-pyridine |
| IUPAC Name | 3-fluoropyridine-2-carbaldehyde |
| InChI Key | OZIMPUNGBUYCSP-UHFFFAOYSA-N |
| Molecular Formula | C6H4FNO |
3-Carboxybenzaldehyde, 97%
CAS: 619-21-6 Molecular Formula: C8H6O3 Molecular Weight (g/mol): 150.133 MDL Number: MFCD00039575 InChI Key: UHDNUPHSDMOGCR-UHFFFAOYSA-N Synonym: 3-carboxybenzaldehyde,benzoic acid, 3-formyl,m-formyl benzoic acid,3-formyl benzoic acid,3-formyl-benzoic acid,unii-hb95grm95d,m-carboxybenzaldehyde,hb95grm95d,3-formylbenzoicacid,isophthalaldehydsaure PubChem CID: 12077 IUPAC Name: 3-formylbenzoic acid SMILES: C1=CC(=CC(=C1)C(=O)O)C=O
| PubChem CID | 12077 |
|---|---|
| CAS | 619-21-6 |
| Molecular Weight (g/mol) | 150.133 |
| MDL Number | MFCD00039575 |
| SMILES | C1=CC(=CC(=C1)C(=O)O)C=O |
| Synonym | 3-carboxybenzaldehyde,benzoic acid, 3-formyl,m-formyl benzoic acid,3-formyl benzoic acid,3-formyl-benzoic acid,unii-hb95grm95d,m-carboxybenzaldehyde,hb95grm95d,3-formylbenzoicacid,isophthalaldehydsaure |
| IUPAC Name | 3-formylbenzoic acid |
| InChI Key | UHDNUPHSDMOGCR-UHFFFAOYSA-N |
| Molecular Formula | C8H6O3 |
3-Chloro-4-hydroxybenzaldehyde, 98%
CAS: 2420-16-8 Molecular Formula: C7H5ClO2 Molecular Weight (g/mol): 156.57 MDL Number: MFCD00016981 InChI Key: VGSOCYWCRMXQAB-UHFFFAOYSA-N Synonym: benzaldehyde, 3-chloro-4-hydroxy,4-hydroxy-3-chlorobenzaldehyde,3-chloro-4-hydroxy-benzaldehyde,benzaldehyde, 3-chloro-4-hydroxy-8ci 9ci,pubchem7764,acmc-1crqk,3-chlor-4-hydroxybenzaldehyde,5-chloro-4-hyroxybenzaldehyde,5-chloro-4-hydroxybenzaldehyde,3-chloro-4-hydroxy benzaldehyde PubChem CID: 17022 IUPAC Name: 3-chloro-4-hydroxybenzaldehyde SMILES: OC1=CC=C(C=O)C=C1Cl
| PubChem CID | 17022 |
|---|---|
| CAS | 2420-16-8 |
| Molecular Weight (g/mol) | 156.57 |
| MDL Number | MFCD00016981 |
| SMILES | OC1=CC=C(C=O)C=C1Cl |
| Synonym | benzaldehyde, 3-chloro-4-hydroxy,4-hydroxy-3-chlorobenzaldehyde,3-chloro-4-hydroxy-benzaldehyde,benzaldehyde, 3-chloro-4-hydroxy-8ci 9ci,pubchem7764,acmc-1crqk,3-chlor-4-hydroxybenzaldehyde,5-chloro-4-hyroxybenzaldehyde,5-chloro-4-hydroxybenzaldehyde,3-chloro-4-hydroxy benzaldehyde |
| IUPAC Name | 3-chloro-4-hydroxybenzaldehyde |
| InChI Key | VGSOCYWCRMXQAB-UHFFFAOYSA-N |
| Molecular Formula | C7H5ClO2 |
2,3-Dihydro-1-benzofuran-7-carbaldehyde, 97%, Thermo Scientific™
CAS: 196799-45-8 Molecular Formula: C9H8O2 Molecular Weight (g/mol): 148.161 MDL Number: MFCD06200853 InChI Key: CLXXUGOCVBQNAI-UHFFFAOYSA-N Synonym: 2,3-dihydrobenzofuran-7-carbaldehyde,2,3-dihydrobenzofuran-7-carboxaldehyde,7-benzofurancarboxaldehyde, 2,3-dihydro,2,3-dihydrobenzo b furan-7-carbaldehyde,7-formyl-2,3-dihydrobenzofuran,2,3-dihydobenzo b furan-7-aldehyde,2,3-dihydro-benzofuran-7-carbaldehyde,2,3-dihydro-benzofuran-7-carboxaldehyde,2.3-dihydro-benzofuran-7-carboxaldehyde,2,3-dihydrobenzo b furan-7-carboxaldehyde PubChem CID: 2795018 IUPAC Name: 2,3-dihydro-1-benzofuran-7-carbaldehyde SMILES: C1COC2=C(C=CC=C21)C=O
| PubChem CID | 2795018 |
|---|---|
| CAS | 196799-45-8 |
| Molecular Weight (g/mol) | 148.161 |
| MDL Number | MFCD06200853 |
| SMILES | C1COC2=C(C=CC=C21)C=O |
| Synonym | 2,3-dihydrobenzofuran-7-carbaldehyde,2,3-dihydrobenzofuran-7-carboxaldehyde,7-benzofurancarboxaldehyde, 2,3-dihydro,2,3-dihydrobenzo b furan-7-carbaldehyde,7-formyl-2,3-dihydrobenzofuran,2,3-dihydobenzo b furan-7-aldehyde,2,3-dihydro-benzofuran-7-carbaldehyde,2,3-dihydro-benzofuran-7-carboxaldehyde,2.3-dihydro-benzofuran-7-carboxaldehyde,2,3-dihydrobenzo b furan-7-carboxaldehyde |
| IUPAC Name | 2,3-dihydro-1-benzofuran-7-carbaldehyde |
| InChI Key | CLXXUGOCVBQNAI-UHFFFAOYSA-N |
| Molecular Formula | C9H8O2 |
1-Methyl-3-thien-2-yl-1H-pyrazole-5-carbaldehyde, 97%, Thermo Scientific™
CAS: 879896-48-7 Molecular Formula: C9H8N2OS Molecular Weight (g/mol): 192.24 MDL Number: MFCD08435884 InChI Key: RKARRIJZFBGKSH-UHFFFAOYSA-N Synonym: 1-methyl-3-thien-2-yl-1h-pyrazole-5-carbaldehyde,1-methyl-3-thiophen-2-yl-1h-pyrazole-5-carbaldehyde,1-methyl-3-thien-2-yl-1h-pyrazole-5-carboxaldehyde,1h-pyrazole-5-carboxaldehyde,1-methyl-3-2-thienyl,2-methyl-5-thiophen-2-yl pyrazole-3-carbaldehyde,1-methyl-3-2-thienyl-1h-pyrazole-5-carbaldehyde,1-methyl-3-2-thienyl pyrazole-5-carbaldehyde,1-methyl-3-2-thienyl-pyrazole-5-carbaldehyde,2-5-formyl-1-methyl-1h-pyrazol-3-yl thiophene PubChem CID: 18525809 IUPAC Name: 2-methyl-5-thiophen-2-ylpyrazole-3-carbaldehyde SMILES: CN1N=C(C=C1C=O)C1=CC=CS1
| PubChem CID | 18525809 |
|---|---|
| CAS | 879896-48-7 |
| Molecular Weight (g/mol) | 192.24 |
| MDL Number | MFCD08435884 |
| SMILES | CN1N=C(C=C1C=O)C1=CC=CS1 |
| Synonym | 1-methyl-3-thien-2-yl-1h-pyrazole-5-carbaldehyde,1-methyl-3-thiophen-2-yl-1h-pyrazole-5-carbaldehyde,1-methyl-3-thien-2-yl-1h-pyrazole-5-carboxaldehyde,1h-pyrazole-5-carboxaldehyde,1-methyl-3-2-thienyl,2-methyl-5-thiophen-2-yl pyrazole-3-carbaldehyde,1-methyl-3-2-thienyl-1h-pyrazole-5-carbaldehyde,1-methyl-3-2-thienyl pyrazole-5-carbaldehyde,1-methyl-3-2-thienyl-pyrazole-5-carbaldehyde,2-5-formyl-1-methyl-1h-pyrazol-3-yl thiophene |
| IUPAC Name | 2-methyl-5-thiophen-2-ylpyrazole-3-carbaldehyde |
| InChI Key | RKARRIJZFBGKSH-UHFFFAOYSA-N |
| Molecular Formula | C9H8N2OS |
3-Allylsalicylaldehyde, 97%
CAS: 24019-66-7 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.188 MDL Number: MFCD00037364 InChI Key: INLWEXRRMUMHKB-UHFFFAOYSA-N Synonym: 3-allyl-2-hydroxybenzaldehyde,3-allylsalicylaldehyde,3-allyl-2-hydroxy-benzaldehyde,benzaldehyde, 2-hydroxy-3-2-propenyl,salicylaldehyde, 3-allyl,2-hydroxy-3-prop-2-en-1-yl benzaldehyde,acmc-209wev,tpc-sk001,2-hydroxy-3-allylbenzaldehyde PubChem CID: 141062 IUPAC Name: 2-hydroxy-3-prop-2-enylbenzaldehyde SMILES: C=CCC1=CC=CC(=C1O)C=O
| PubChem CID | 141062 |
|---|---|
| CAS | 24019-66-7 |
| Molecular Weight (g/mol) | 162.188 |
| MDL Number | MFCD00037364 |
| SMILES | C=CCC1=CC=CC(=C1O)C=O |
| Synonym | 3-allyl-2-hydroxybenzaldehyde,3-allylsalicylaldehyde,3-allyl-2-hydroxy-benzaldehyde,benzaldehyde, 2-hydroxy-3-2-propenyl,salicylaldehyde, 3-allyl,2-hydroxy-3-prop-2-en-1-yl benzaldehyde,acmc-209wev,tpc-sk001,2-hydroxy-3-allylbenzaldehyde |
| IUPAC Name | 2-hydroxy-3-prop-2-enylbenzaldehyde |
| InChI Key | INLWEXRRMUMHKB-UHFFFAOYSA-N |
| Molecular Formula | C10H10O2 |
4-Pentyn-1-ol, 95%
CAS: 5390-04-5 Molecular Formula: C5H8O Molecular Weight (g/mol): 84.12 MDL Number: MFCD00002974 InChI Key: CRWVOXFUXPYTRK-UHFFFAOYSA-N Synonym: 6-bromoveratraldehyde,6-bromo-3,4-dimethoxybenzaldehyde,benzaldehyde, 2-bromo-4,5-dimethoxy,6-bromo veratraldehyde,2-bromo-4,5-dimethoxybenzalehyde,4,5-dimethoxy-2-bromobenzaldehyde,6-bromoveratral,pubchem8209,veratraldehyde, 6-bromo,acmc-2097hh PubChem CID: 79351 SMILES: OCCCC#C
| PubChem CID | 79351 |
|---|---|
| CAS | 5390-04-5 |
| Molecular Weight (g/mol) | 84.12 |
| MDL Number | MFCD00002974 |
| SMILES | OCCCC#C |
| Synonym | 6-bromoveratraldehyde,6-bromo-3,4-dimethoxybenzaldehyde,benzaldehyde, 2-bromo-4,5-dimethoxy,6-bromo veratraldehyde,2-bromo-4,5-dimethoxybenzalehyde,4,5-dimethoxy-2-bromobenzaldehyde,6-bromoveratral,pubchem8209,veratraldehyde, 6-bromo,acmc-2097hh |
| InChI Key | CRWVOXFUXPYTRK-UHFFFAOYSA-N |
| Molecular Formula | C5H8O |
2-Chloro-3-pyridinecarboxaldehyde, 98%
CAS: 36404-88-3 Molecular Formula: C6H4ClNO Molecular Weight (g/mol): 141.56 MDL Number: MFCD01315308 InChI Key: KHPAGGHFIDLUMB-UHFFFAOYSA-N Synonym: 2-chloro-3-formylpyridine,2-chloronicotinaldehyde,2-chloro-3-pyridinecarboxaldehyde,2-chloro-pyridine-3-carbaldehyde,chloro-2-formyl-3-pyridine,2-chloropyridine-3-carboxaldehyde,3-pyridinecarboxaldehyde, 2-chloro,2-chloro-3-pyridinecarbaldehyde,2-chloro-3-pyridinecarboxyaldehyde,2-chloro-pyridin-3-carbaldehyde PubChem CID: 737607 IUPAC Name: 2-chloropyridine-3-carbaldehyde SMILES: C1=CC(=C(N=C1)Cl)C=O
| PubChem CID | 737607 |
|---|---|
| CAS | 36404-88-3 |
| Molecular Weight (g/mol) | 141.56 |
| MDL Number | MFCD01315308 |
| SMILES | C1=CC(=C(N=C1)Cl)C=O |
| Synonym | 2-chloro-3-formylpyridine,2-chloronicotinaldehyde,2-chloro-3-pyridinecarboxaldehyde,2-chloro-pyridine-3-carbaldehyde,chloro-2-formyl-3-pyridine,2-chloropyridine-3-carboxaldehyde,3-pyridinecarboxaldehyde, 2-chloro,2-chloro-3-pyridinecarbaldehyde,2-chloro-3-pyridinecarboxyaldehyde,2-chloro-pyridin-3-carbaldehyde |
| IUPAC Name | 2-chloropyridine-3-carbaldehyde |
| InChI Key | KHPAGGHFIDLUMB-UHFFFAOYSA-N |
| Molecular Formula | C6H4ClNO |
trans,trans-2,4-Dodecadienal, 90+%, remainder mainly trans, cis isomer
CAS: 21662-16-8 Molecular Formula: C12H20O Molecular Weight (g/mol): 180.29 MDL Number: MFCD00014678 InChI Key: QKTZBZWNADPFOL-BNFZFUHLSA-N Synonym: 2e,4e-dodeca-2,4-dienal,2,4-dodecadienal,e,e-2,4-dodecadienal,trans,trans-2,4-dodecadienal,2,4-dodecadien-1-al,2e,4e-2,4-dodecadienal,e,e-2,4-dodecadien-1-al,2,4-dodecadienal, e,e,unii-vo340rj9lu PubChem CID: 5367530 IUPAC Name: (2E,4E)-dodeca-2,4-dienal SMILES: CCCCCCC\C=C\C=C\C=O
| PubChem CID | 5367530 |
|---|---|
| CAS | 21662-16-8 |
| Molecular Weight (g/mol) | 180.29 |
| MDL Number | MFCD00014678 |
| SMILES | CCCCCCC\C=C\C=C\C=O |
| Synonym | 2e,4e-dodeca-2,4-dienal,2,4-dodecadienal,e,e-2,4-dodecadienal,trans,trans-2,4-dodecadienal,2,4-dodecadien-1-al,2e,4e-2,4-dodecadienal,e,e-2,4-dodecadien-1-al,2,4-dodecadienal, e,e,unii-vo340rj9lu |
| IUPAC Name | (2E,4E)-dodeca-2,4-dienal |
| InChI Key | QKTZBZWNADPFOL-BNFZFUHLSA-N |
| Molecular Formula | C12H20O |
Vanillin, NF, 97-103%, Spectrum™ Chemical
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CAS: 121-33-5 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00006942,MFCD08702848 InChI Key: MWOOGOJBHIARFG-UHFFFAOYSA-N IUPAC Name: 4-hydroxy-3-methoxybenzaldehyde SMILES: COC1=CC(C=O)=CC=C1O
| CAS | 121-33-5 |
|---|---|
| Molecular Weight (g/mol) | 152.15 |
| MDL Number | MFCD00006942,MFCD08702848 |
| SMILES | COC1=CC(C=O)=CC=C1O |
| IUPAC Name | 4-hydroxy-3-methoxybenzaldehyde |
| InChI Key | MWOOGOJBHIARFG-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
3-Methoxythiophene, 98%
CAS: 17573-92-1 Molecular Formula: C5H6OS Molecular Weight (g/mol): 114.17 MDL Number: MFCD00043894 InChI Key: RFSKGCVUDQRZSD-UHFFFAOYSA-N Synonym: thiophene, 3-methoxy,3-methoxy-thiophene,pubchem8863,acmc-1bow6,3-methoxythiophene,ksc491i4p,bidd:gt0411 PubChem CID: 140249 IUPAC Name: 3-methoxythiophene SMILES: COC1=CSC=C1
| PubChem CID | 140249 |
|---|---|
| CAS | 17573-92-1 |
| Molecular Weight (g/mol) | 114.17 |
| MDL Number | MFCD00043894 |
| SMILES | COC1=CSC=C1 |
| Synonym | thiophene, 3-methoxy,3-methoxy-thiophene,pubchem8863,acmc-1bow6,3-methoxythiophene,ksc491i4p,bidd:gt0411 |
| IUPAC Name | 3-methoxythiophene |
| InChI Key | RFSKGCVUDQRZSD-UHFFFAOYSA-N |
| Molecular Formula | C5H6OS |
Triethyl orthopropionate, 97%
CAS: 115-80-0 Molecular Formula: C9H20O3 Molecular Weight (g/mol): 176.26 MDL Number: MFCD00009226 InChI Key: FGWYWKIOMUZSQF-UHFFFAOYSA-N Synonym: triethyl orthopropionate,ethyl orthopropionate,propane, 1,1,1-triethoxy,triethylorthopropionate,triethyl o-propionate,orthopropionic acid ethyl ester,orthopropionic acid, triethyl ester,unii-9uvm48bas9,9uvm48bas9,1,1,1-triethoxypropan PubChem CID: 66995 IUPAC Name: 1,1,1-triethoxypropane SMILES: CCOC(CC)(OCC)OCC
| PubChem CID | 66995 |
|---|---|
| CAS | 115-80-0 |
| Molecular Weight (g/mol) | 176.26 |
| MDL Number | MFCD00009226 |
| SMILES | CCOC(CC)(OCC)OCC |
| Synonym | triethyl orthopropionate,ethyl orthopropionate,propane, 1,1,1-triethoxy,triethylorthopropionate,triethyl o-propionate,orthopropionic acid ethyl ester,orthopropionic acid, triethyl ester,unii-9uvm48bas9,9uvm48bas9,1,1,1-triethoxypropan |
| IUPAC Name | 1,1,1-triethoxypropane |
| InChI Key | FGWYWKIOMUZSQF-UHFFFAOYSA-N |
| Molecular Formula | C9H20O3 |