Organooxygen compounds
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1,1,1,2,2,3,4,5,5,5-Decafluoro-3-methoxy-4-(trifluoromethyl)pentane 98.0+%, TCI America™
CAS: 132182-92-4 Molecular Formula: C7H3F13O Molecular Weight (g/mol): 350.079 MDL Number: MFCD07784227 InChI Key: QKAGYSDHEJITFV-UHFFFAOYSA-N PubChem CID: 14689855 IUPAC Name: 1,1,1,2,2,3,4,5,5,5-decafluoro-3-methoxy-4-(trifluoromethyl)pentane SMILES: COC(C(C(F)(F)F)(C(F)(F)F)F)(C(C(F)(F)F)(F)F)F
| PubChem CID | 14689855 |
|---|---|
| CAS | 132182-92-4 |
| Molecular Weight (g/mol) | 350.079 |
| MDL Number | MFCD07784227 |
| SMILES | COC(C(C(F)(F)F)(C(F)(F)F)F)(C(C(F)(F)F)(F)F)F |
| IUPAC Name | 1,1,1,2,2,3,4,5,5,5-decafluoro-3-methoxy-4-(trifluoromethyl)pentane |
| InChI Key | QKAGYSDHEJITFV-UHFFFAOYSA-N |
| Molecular Formula | C7H3F13O |
3,3-Diethoxypropionitrile 95.0+%, TCI America™
CAS: 2032-34-0 Molecular Formula: C7H13NO2 Molecular Weight (g/mol): 143.19 MDL Number: MFCD00040558 InChI Key: WBOXEOCWOCJQNK-UHFFFAOYSA-N Synonym: 3,3-diethoxypropionitrile,3,3-diethoxypropiononitrile,propanenitrile, 3,3-diethoxy,cyanoacetaldehyde diethyl acetal,1,1-diethoxy-2-cyanoethane,3,3-diethoxy propionitrile,cyadea,acmc-1cmza,3,3-diethoxypropanitrile,3,3-diethoxypropiononitril PubChem CID: 74851 IUPAC Name: 3,3-diethoxypropanenitrile SMILES: CCOC(CC#N)OCC
| PubChem CID | 74851 |
|---|---|
| CAS | 2032-34-0 |
| Molecular Weight (g/mol) | 143.19 |
| MDL Number | MFCD00040558 |
| SMILES | CCOC(CC#N)OCC |
| Synonym | 3,3-diethoxypropionitrile,3,3-diethoxypropiononitrile,propanenitrile, 3,3-diethoxy,cyanoacetaldehyde diethyl acetal,1,1-diethoxy-2-cyanoethane,3,3-diethoxy propionitrile,cyadea,acmc-1cmza,3,3-diethoxypropanitrile,3,3-diethoxypropiononitril |
| IUPAC Name | 3,3-diethoxypropanenitrile |
| InChI Key | WBOXEOCWOCJQNK-UHFFFAOYSA-N |
| Molecular Formula | C7H13NO2 |
2,6-Dimethoxybenzaldehyde 97.0+%, TCI America™
CAS: 3392-97-0 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00010862 InChI Key: WXSGQHKHUYTJNB-UHFFFAOYSA-N Synonym: benzaldehyde, 2,6-dimethoxy,unii-54p7cg8v99,pubchem8226,acmc-1ckys,2,6 dimethoxybenzaldehyde,2,6-dimethoxy-benzaldehyde,ksc497m3h,1,3-dimethoxy-2-formylbenzene,paragos 460025,timtec-bb sbb006541 PubChem CID: 96404 IUPAC Name: 2,6-dimethoxybenzaldehyde SMILES: COC1=CC=CC(OC)=C1C=O
| PubChem CID | 96404 |
|---|---|
| CAS | 3392-97-0 |
| Molecular Weight (g/mol) | 166.18 |
| MDL Number | MFCD00010862 |
| SMILES | COC1=CC=CC(OC)=C1C=O |
| Synonym | benzaldehyde, 2,6-dimethoxy,unii-54p7cg8v99,pubchem8226,acmc-1ckys,2,6 dimethoxybenzaldehyde,2,6-dimethoxy-benzaldehyde,ksc497m3h,1,3-dimethoxy-2-formylbenzene,paragos 460025,timtec-bb sbb006541 |
| IUPAC Name | 2,6-dimethoxybenzaldehyde |
| InChI Key | WXSGQHKHUYTJNB-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
3,5-Dimethylcyclohexanol (mixture of isomers) 98.0+%, TCI America™
CAS: 5441-52-1 Molecular Formula: C8H16O Molecular Weight (g/mol): 128.215 MDL Number: MFCD00001447 InChI Key: WIYNOPYNRFPWNB-UHFFFAOYSA-N PubChem CID: 21584 IUPAC Name: 3,5-dimethylcyclohexan-1-ol SMILES: CC1CC(CC(C1)O)C
| PubChem CID | 21584 |
|---|---|
| CAS | 5441-52-1 |
| Molecular Weight (g/mol) | 128.215 |
| MDL Number | MFCD00001447 |
| SMILES | CC1CC(CC(C1)O)C |
| IUPAC Name | 3,5-dimethylcyclohexan-1-ol |
| InChI Key | WIYNOPYNRFPWNB-UHFFFAOYSA-N |
| Molecular Formula | C8H16O |
2-Aminonicotinaldehyde 97.0+%, TCI America™
CAS: 7521-41-7 Molecular Formula: C6H6N2O Molecular Weight (g/mol): 122.127 InChI Key: NXMFJCRMSDRXLD-UHFFFAOYSA-N Synonym: 2-aminonicotinaldehyde,2-amino-3-pyridinecarboxaldehyde,2-amino-3-formylpyridine,3-pyridinecarboxaldehyde, 2-amino,2-amino-pyridine-3-carbaldehyde,2-aminopyridine-3-carboxaldehyde,2-amino-3-pyridine carboxaldehyde,2-amino-pyridin-3-carbaldehyde,pubchem1262,2-amino nicotinaldehyde PubChem CID: 737633 IUPAC Name: 2-aminopyridine-3-carbaldehyde SMILES: C1=CC(=C(N=C1)N)C=O
| PubChem CID | 737633 |
|---|---|
| CAS | 7521-41-7 |
| Molecular Weight (g/mol) | 122.127 |
| SMILES | C1=CC(=C(N=C1)N)C=O |
| Synonym | 2-aminonicotinaldehyde,2-amino-3-pyridinecarboxaldehyde,2-amino-3-formylpyridine,3-pyridinecarboxaldehyde, 2-amino,2-amino-pyridine-3-carbaldehyde,2-aminopyridine-3-carboxaldehyde,2-amino-3-pyridine carboxaldehyde,2-amino-pyridin-3-carbaldehyde,pubchem1262,2-amino nicotinaldehyde |
| IUPAC Name | 2-aminopyridine-3-carbaldehyde |
| InChI Key | NXMFJCRMSDRXLD-UHFFFAOYSA-N |
| Molecular Formula | C6H6N2O |
5-Methoxy-2-methylbenzothiazole 98.0+%, TCI America™
CAS: 2941-69-7 Molecular Formula: C9H9NOS Molecular Weight (g/mol): 179.24 MDL Number: MFCD00082664 InChI Key: SAQMNBWVOKYKPZ-UHFFFAOYSA-N PubChem CID: 76252 IUPAC Name: 5-methoxy-2-methyl-1,3-benzothiazole SMILES: COC1=CC=C2SC(C)=NC2=C1
| PubChem CID | 76252 |
|---|---|
| CAS | 2941-69-7 |
| Molecular Weight (g/mol) | 179.24 |
| MDL Number | MFCD00082664 |
| SMILES | COC1=CC=C2SC(C)=NC2=C1 |
| IUPAC Name | 5-methoxy-2-methyl-1,3-benzothiazole |
| InChI Key | SAQMNBWVOKYKPZ-UHFFFAOYSA-N |
| Molecular Formula | C9H9NOS |
| PubChem CID | 2763087 |
|---|---|
| CAS | 850991-69-4 |
| Molecular Weight (g/mol) | 152.944 |
| MDL Number | MFCD03425977 |
| Color | White |
| Physical Form | Crystalline Powder |
| SMILES | B(C1=CC(=CN=C1)OC)(O)O |
| TSCA | No |
| IUPAC Name | (5-methoxypyridin-3-yl)boronic acid |
| InChI Key | ISDFOFZTZUILPE-UHFFFAOYSA-N |
| Molecular Formula | C6H8BNO3 |
| Formula Weight | 152.94 |
2-[(S)-1-Hydroxyethyl]pyridine 97.0+%, TCI America™
CAS: 59042-90-9 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.16 MDL Number: MFCD06795465 InChI Key: PPHIIIRFJKDTLG-UHFFFAOYNA-N Synonym: s-1-pyridin-2-yl ethanol,s-1-2-pyridyl ethanol,2-s-1-hydroxyethyl pyridine,s---2-1-hydroxyethyl pyridine,s-2-1-hydroxyethyl pyridine,1s-1-pyridin-2-yl ethan-1-ol,1s-1-pyridin-2-yl ethanol,s-1-2-pyridyl ethanol, s-2-1-hydroxyethyl pyridine,pubchem5701,1s-1-pyridin-2-ylethanol PubChem CID: 11094597 IUPAC Name: 1-(pyridin-2-yl)ethan-1-ol SMILES: CC(O)C1=CC=CC=N1
| PubChem CID | 11094597 |
|---|---|
| CAS | 59042-90-9 |
| Molecular Weight (g/mol) | 123.16 |
| MDL Number | MFCD06795465 |
| SMILES | CC(O)C1=CC=CC=N1 |
| Synonym | s-1-pyridin-2-yl ethanol,s-1-2-pyridyl ethanol,2-s-1-hydroxyethyl pyridine,s---2-1-hydroxyethyl pyridine,s-2-1-hydroxyethyl pyridine,1s-1-pyridin-2-yl ethan-1-ol,1s-1-pyridin-2-yl ethanol,s-1-2-pyridyl ethanol, s-2-1-hydroxyethyl pyridine,pubchem5701,1s-1-pyridin-2-ylethanol |
| IUPAC Name | 1-(pyridin-2-yl)ethan-1-ol |
| InChI Key | PPHIIIRFJKDTLG-UHFFFAOYNA-N |
| Molecular Formula | C7H9NO |
2,3-Dimethylanthraquinone 95.0+%, TCI America™
CAS: 6531-35-7 Molecular Formula: C16H12O2 Molecular Weight (g/mol): 236.27 InChI Key: KIJPZYXCIHZVGP-UHFFFAOYSA-N PubChem CID: 81019 IUPAC Name: 2,3-dimethylanthracene-9,10-dione SMILES: CC1=C(C=C2C(=C1)C(=O)C3=CC=CC=C3C2=O)C
| PubChem CID | 81019 |
|---|---|
| CAS | 6531-35-7 |
| Molecular Weight (g/mol) | 236.27 |
| SMILES | CC1=C(C=C2C(=C1)C(=O)C3=CC=CC=C3C2=O)C |
| IUPAC Name | 2,3-dimethylanthracene-9,10-dione |
| InChI Key | KIJPZYXCIHZVGP-UHFFFAOYSA-N |
| Molecular Formula | C16H12O2 |
Nonanal 95.0+%, TCI America™
CAS: 124-19-6 Molecular Formula: C9H18O Molecular Weight (g/mol): 142.242 MDL Number: MFCD00007030 InChI Key: GYHFUZHODSMOHU-UHFFFAOYSA-N Synonym: pelargonaldehyde,1-nonanal,nonanaldehyde,nonyl aldehyde,n-nonaldehyde,nonylic aldehyde,nonylaldehyde,nonaldehyde,n-nonanal,1-nonaldehyde PubChem CID: 31289 ChEBI: CHEBI:84268 IUPAC Name: nonanal SMILES: CCCCCCCCC=O
| PubChem CID | 31289 |
|---|---|
| CAS | 124-19-6 |
| Molecular Weight (g/mol) | 142.242 |
| ChEBI | CHEBI:84268 |
| MDL Number | MFCD00007030 |
| SMILES | CCCCCCCCC=O |
| Synonym | pelargonaldehyde,1-nonanal,nonanaldehyde,nonyl aldehyde,n-nonaldehyde,nonylic aldehyde,nonylaldehyde,nonaldehyde,n-nonanal,1-nonaldehyde |
| IUPAC Name | nonanal |
| InChI Key | GYHFUZHODSMOHU-UHFFFAOYSA-N |
| Molecular Formula | C9H18O |
cis-4-(Hydroxymethyl)cyclohexanecarboxylic Acid 98.0+%, TCI America™
CAS: 73094-35-6 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.197 InChI Key: VQMIUUBKKPIDBN-UHFFFAOYSA-N PubChem CID: 202819 IUPAC Name: 4-(hydroxymethyl)cyclohexane-1-carboxylic acid SMILES: C1CC(CCC1CO)C(=O)O
| PubChem CID | 202819 |
|---|---|
| CAS | 73094-35-6 |
| Molecular Weight (g/mol) | 158.197 |
| SMILES | C1CC(CCC1CO)C(=O)O |
| IUPAC Name | 4-(hydroxymethyl)cyclohexane-1-carboxylic acid |
| InChI Key | VQMIUUBKKPIDBN-UHFFFAOYSA-N |
| Molecular Formula | C8H14O3 |
1,4-Diamino-2,3-dichloroanthraquinone 93.0+%, TCI America™
CAS: 81-42-5 Molecular Formula: C14H8Cl2N2O2 Molecular Weight (g/mol): 307.13 MDL Number: MFCD00035693 InChI Key: KZYAYVSWIPZDKL-UHFFFAOYSA-N Synonym: Disperse Violet 28 PubChem CID: 65731 IUPAC Name: 1,4-diamino-2,3-dichloro-9,10-dihydroanthracene-9,10-dione SMILES: NC1=C(Cl)C(Cl)=C(N)C2=C1C(=O)C1=CC=CC=C1C2=O
| PubChem CID | 65731 |
|---|---|
| CAS | 81-42-5 |
| Molecular Weight (g/mol) | 307.13 |
| MDL Number | MFCD00035693 |
| SMILES | NC1=C(Cl)C(Cl)=C(N)C2=C1C(=O)C1=CC=CC=C1C2=O |
| Synonym | Disperse Violet 28 |
| IUPAC Name | 1,4-diamino-2,3-dichloro-9,10-dihydroanthracene-9,10-dione |
| InChI Key | KZYAYVSWIPZDKL-UHFFFAOYSA-N |
| Molecular Formula | C14H8Cl2N2O2 |
2,2-Bis(bromomethyl)-1,3-propanediol 98.0+%, TCI America™
CAS: 3296-90-0 Molecular Formula: C5H10Br2O2 Molecular Weight (g/mol): 261.94 MDL Number: MFCD00004688 InChI Key: CHUGKEQJSLOLHL-UHFFFAOYSA-N Synonym: Dibromoneopentyl Glycol PubChem CID: 18692 ChEBI: CHEBI:82294 IUPAC Name: 2,2-bis(bromomethyl)propane-1,3-diol SMILES: OCC(CO)(CBr)CBr
| PubChem CID | 18692 |
|---|---|
| CAS | 3296-90-0 |
| Molecular Weight (g/mol) | 261.94 |
| ChEBI | CHEBI:82294 |
| MDL Number | MFCD00004688 |
| SMILES | OCC(CO)(CBr)CBr |
| Synonym | Dibromoneopentyl Glycol |
| IUPAC Name | 2,2-bis(bromomethyl)propane-1,3-diol |
| InChI Key | CHUGKEQJSLOLHL-UHFFFAOYSA-N |
| Molecular Formula | C5H10Br2O2 |
Ethyl 2-Hexylacetoacetate 95.0+%, TCI America™
CAS: 29214-60-6 Molecular Formula: C12H22O3 Molecular Weight (g/mol): 214.305 MDL Number: MFCD00026889 InChI Key: BRGRZPQESQKATK-UHFFFAOYSA-N Synonym: 2-Acetyl-n-octanoic Acid Ethyl Ester, Ethyl 2-Acetyl-n-octanoate, Hexylacetoacetic Acid Ethyl Ester PubChem CID: 121790 IUPAC Name: ethyl 2-acetyloctanoate SMILES: CCCCCCC(C(=O)C)C(=O)OCC
| PubChem CID | 121790 |
|---|---|
| CAS | 29214-60-6 |
| Molecular Weight (g/mol) | 214.305 |
| MDL Number | MFCD00026889 |
| SMILES | CCCCCCC(C(=O)C)C(=O)OCC |
| Synonym | 2-Acetyl-n-octanoic Acid Ethyl Ester, Ethyl 2-Acetyl-n-octanoate, Hexylacetoacetic Acid Ethyl Ester |
| IUPAC Name | ethyl 2-acetyloctanoate |
| InChI Key | BRGRZPQESQKATK-UHFFFAOYSA-N |
| Molecular Formula | C12H22O3 |
2,3-Dimethyl-2-hexanol 99.0+%, TCI America™
CAS: 19550-03-9 Molecular Formula: C8H18O Molecular Weight (g/mol): 130.231 MDL Number: MFCD00021806 InChI Key: BFKOEFFCVFMWPF-UHFFFAOYSA-N PubChem CID: 137270 IUPAC Name: 2,3-dimethylhexan-2-ol SMILES: CCCC(C)C(C)(C)O
| PubChem CID | 137270 |
|---|---|
| CAS | 19550-03-9 |
| Molecular Weight (g/mol) | 130.231 |
| MDL Number | MFCD00021806 |
| SMILES | CCCC(C)C(C)(C)O |
| IUPAC Name | 2,3-dimethylhexan-2-ol |
| InChI Key | BFKOEFFCVFMWPF-UHFFFAOYSA-N |
| Molecular Formula | C8H18O |