Organooxygen compounds
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[2-(2-Methoxyethoxy)ethoxy]acetic Acid 95.0+%, TCI America™
CAS: 16024-58-1 Molecular Formula: C7H14O5 Molecular Weight (g/mol): 178.184 MDL Number: MFCD00044098 InChI Key: YHBWXWLDOKIVCJ-UHFFFAOYSA-N Synonym: 3,6,9-Trioxadecanoic Acid PubChem CID: 85241 IUPAC Name: 2-[2-(2-methoxyethoxy)ethoxy]acetic acid SMILES: COCCOCCOCC(=O)O
| PubChem CID | 85241 |
|---|---|
| CAS | 16024-58-1 |
| Molecular Weight (g/mol) | 178.184 |
| MDL Number | MFCD00044098 |
| SMILES | COCCOCCOCC(=O)O |
| Synonym | 3,6,9-Trioxadecanoic Acid |
| IUPAC Name | 2-[2-(2-methoxyethoxy)ethoxy]acetic acid |
| InChI Key | YHBWXWLDOKIVCJ-UHFFFAOYSA-N |
| Molecular Formula | C7H14O5 |
(R)-(-)-1-Methoxy-2-propanol 98.0+%, TCI America™
CAS: 4984-22-9 Molecular Formula: C4H10O2 Molecular Weight (g/mol): 90.122 MDL Number: MFCD01632587 InChI Key: ARXJGSRGQADJSQ-SCSAIBSYSA-N Synonym: r---1-methoxy-2-propanol,2r-1-methoxypropan-2-ol,r-1-methoxypropan-2-ol,r-1-methoxy-2-propanol,r-1-methoxy-propan-2-ol,2-propanol, 1-methoxy-, 2r,20s-2,5,8,11,14,17-hexamethyl-3,6,9,12,15,18-hexaoxahenicosane-1,20-diol,pubchem6714,r-methoxy-propan-2-ol PubChem CID: 2733589 IUPAC Name: (2R)-1-methoxypropan-2-ol SMILES: CC(COC)O
| PubChem CID | 2733589 |
|---|---|
| CAS | 4984-22-9 |
| Molecular Weight (g/mol) | 90.122 |
| MDL Number | MFCD01632587 |
| SMILES | CC(COC)O |
| Synonym | r---1-methoxy-2-propanol,2r-1-methoxypropan-2-ol,r-1-methoxypropan-2-ol,r-1-methoxy-2-propanol,r-1-methoxy-propan-2-ol,2-propanol, 1-methoxy-, 2r,20s-2,5,8,11,14,17-hexamethyl-3,6,9,12,15,18-hexaoxahenicosane-1,20-diol,pubchem6714,r-methoxy-propan-2-ol |
| IUPAC Name | (2R)-1-methoxypropan-2-ol |
| InChI Key | ARXJGSRGQADJSQ-SCSAIBSYSA-N |
| Molecular Formula | C4H10O2 |
Propioin 95.0+%, TCI America™
CAS: 4984-85-4 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00043572 InChI Key: SKCYVGUCBRYGTE-UHFFFAOYSA-N Synonym: 4-Hydroxy-3-hexanone PubChem CID: 95609 ChEBI: CHEBI:18351 IUPAC Name: 4-hydroxyhexan-3-one SMILES: CCC(C(=O)CC)O
| PubChem CID | 95609 |
|---|---|
| CAS | 4984-85-4 |
| Molecular Weight (g/mol) | 116.16 |
| ChEBI | CHEBI:18351 |
| MDL Number | MFCD00043572 |
| SMILES | CCC(C(=O)CC)O |
| Synonym | 4-Hydroxy-3-hexanone |
| IUPAC Name | 4-hydroxyhexan-3-one |
| InChI Key | SKCYVGUCBRYGTE-UHFFFAOYSA-N |
| Molecular Formula | C6H12O2 |
Butyl Acetoacetate 98.0+%, TCI America™
CAS: 591-60-6 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.20 MDL Number: MFCD00059252 InChI Key: REIYHFWZISXFKU-UHFFFAOYSA-N Synonym: Acetoacetic Acid Butyl Ester PubChem CID: 11576 IUPAC Name: butyl 3-oxobutanoate SMILES: CCCCOC(=O)CC(C)=O
| PubChem CID | 11576 |
|---|---|
| CAS | 591-60-6 |
| Molecular Weight (g/mol) | 158.20 |
| MDL Number | MFCD00059252 |
| SMILES | CCCCOC(=O)CC(C)=O |
| Synonym | Acetoacetic Acid Butyl Ester |
| IUPAC Name | butyl 3-oxobutanoate |
| InChI Key | REIYHFWZISXFKU-UHFFFAOYSA-N |
| Molecular Formula | C8H14O3 |
4-Cyanophenacyl Bromide 96.0+%, TCI America™
CAS: 20099-89-2 Molecular Formula: C9H6BrNO Molecular Weight (g/mol): 224.057 MDL Number: MFCD00052931 InChI Key: LJANCPRIUMHGJE-UHFFFAOYSA-N Synonym: 4-2-bromoacetyl benzonitrile,4-cyanophenacyl bromide,4-bromoacetyl benzonitrile,2-bromo-4'-cyanoacetophenone,benzonitrile, 4-bromoacetyl,p-cyanophenacyl bromide,4-2-bromo-acetyl-benzonitrile,4-2-bromoethanoyl benzonitrile,4-2-bromoacetyl benzenecarbonitrile PubChem CID: 98654 IUPAC Name: 4-(2-bromoacetyl)benzonitrile SMILES: C1=CC(=CC=C1C#N)C(=O)CBr
| PubChem CID | 98654 |
|---|---|
| CAS | 20099-89-2 |
| Molecular Weight (g/mol) | 224.057 |
| MDL Number | MFCD00052931 |
| SMILES | C1=CC(=CC=C1C#N)C(=O)CBr |
| Synonym | 4-2-bromoacetyl benzonitrile,4-cyanophenacyl bromide,4-bromoacetyl benzonitrile,2-bromo-4'-cyanoacetophenone,benzonitrile, 4-bromoacetyl,p-cyanophenacyl bromide,4-2-bromo-acetyl-benzonitrile,4-2-bromoethanoyl benzonitrile,4-2-bromoacetyl benzenecarbonitrile |
| IUPAC Name | 4-(2-bromoacetyl)benzonitrile |
| InChI Key | LJANCPRIUMHGJE-UHFFFAOYSA-N |
| Molecular Formula | C9H6BrNO |
4'-Hydroxy-3'-nitroacetophenone 98.0+%, TCI America™
CAS: 6322-56-1 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.147 MDL Number: MFCD00017002 InChI Key: MMNKVWGVSHRIJL-UHFFFAOYSA-N Synonym: 4'-hydroxy-3'-nitroacetophenone,4-hydroxy-3-nitroacetophenone,1-4-hydroxy-3-nitrophenyl ethanone,4-acetyl-2-nitro-phenol,1-4-hydroxy-3-nitrophenyl-1-ethanone,1-4-hydroxy-3-nitrophenyl ethan-1-one,2-nitro-4-acetylphenol,4-acetyl-2-nitrophenol,1-4-hydroxy-3-nitro-phenyl ethanone,ethanone, 1-4-hydroxy-3-nitrophenyl PubChem CID: 138723 SMILES: CC(=O)C1=CC(=C(C=C1)O)[N+](=O)[O-]
| PubChem CID | 138723 |
|---|---|
| CAS | 6322-56-1 |
| Molecular Weight (g/mol) | 181.147 |
| MDL Number | MFCD00017002 |
| SMILES | CC(=O)C1=CC(=C(C=C1)O)[N+](=O)[O-] |
| Synonym | 4'-hydroxy-3'-nitroacetophenone,4-hydroxy-3-nitroacetophenone,1-4-hydroxy-3-nitrophenyl ethanone,4-acetyl-2-nitro-phenol,1-4-hydroxy-3-nitrophenyl-1-ethanone,1-4-hydroxy-3-nitrophenyl ethan-1-one,2-nitro-4-acetylphenol,4-acetyl-2-nitrophenol,1-4-hydroxy-3-nitro-phenyl ethanone,ethanone, 1-4-hydroxy-3-nitrophenyl |
| InChI Key | MMNKVWGVSHRIJL-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO4 |
Dimethyl Methoxymalonate 95.0+%, TCI America™
CAS: 5018-30-4 Molecular Formula: C6H10O5 Molecular Weight (g/mol): 162.14 MDL Number: MFCD00009847 InChI Key: ORXJMBXYSGGCHG-UHFFFAOYSA-N Synonym: Methoxymalonic Acid Dimethyl Ester PubChem CID: 78718 IUPAC Name: 1,3-dimethyl 2-methoxypropanedioate SMILES: COC(C(=O)OC)C(=O)OC
| PubChem CID | 78718 |
|---|---|
| CAS | 5018-30-4 |
| Molecular Weight (g/mol) | 162.14 |
| MDL Number | MFCD00009847 |
| SMILES | COC(C(=O)OC)C(=O)OC |
| Synonym | Methoxymalonic Acid Dimethyl Ester |
| IUPAC Name | 1,3-dimethyl 2-methoxypropanedioate |
| InChI Key | ORXJMBXYSGGCHG-UHFFFAOYSA-N |
| Molecular Formula | C6H10O5 |
2-Bromo-4'-phenylacetophenone 98.0+%, TCI America™
CAS: 135-73-9 Molecular Formula: C14H11BrO Molecular Weight (g/mol): 275.145 MDL Number: MFCD00000202 InChI Key: KGHGZRVXCKCJGX-UHFFFAOYSA-N Synonym: 2-bromo-4'-phenylacetophenone,4-phenylphenacyl bromide,p-bromoacetylbiphenyl,p-phenylphenacyl bromide,bromomethyl p-biphenylyl ketone,ethanone, 1-1,1'-biphenyl-4-yl-2-bromo,2-bromo-1-4-phenylphenyl ethan-1-one,acetophenone, 2-bromo-4'-phenyl,alpha-bromo-p-phenylacetophenone,omega-bromo-4-phenylacetophenone PubChem CID: 67282 IUPAC Name: 2-bromo-1-(4-phenylphenyl)ethanone SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CBr
| PubChem CID | 67282 |
|---|---|
| CAS | 135-73-9 |
| Molecular Weight (g/mol) | 275.145 |
| MDL Number | MFCD00000202 |
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CBr |
| Synonym | 2-bromo-4'-phenylacetophenone,4-phenylphenacyl bromide,p-bromoacetylbiphenyl,p-phenylphenacyl bromide,bromomethyl p-biphenylyl ketone,ethanone, 1-1,1'-biphenyl-4-yl-2-bromo,2-bromo-1-4-phenylphenyl ethan-1-one,acetophenone, 2-bromo-4'-phenyl,alpha-bromo-p-phenylacetophenone,omega-bromo-4-phenylacetophenone |
| IUPAC Name | 2-bromo-1-(4-phenylphenyl)ethanone |
| InChI Key | KGHGZRVXCKCJGX-UHFFFAOYSA-N |
| Molecular Formula | C14H11BrO |
Butyroin 96.0+%, TCI America™
CAS: 496-77-5 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.21 MDL Number: MFCD00021928 InChI Key: BVEYJWQCMOVMAR-UHFFFAOYNA-N Synonym: butyroin,5-hydroxy-4-octanone,4-octanone, 5-hydroxy,5-octanol-4-one,octan-4-ol-5-one,fema no. 2587,5-hydroxy-octan-4-one,acmc-1aijr,ksc236m9n,+/--5-hydroxy-4-octanone PubChem CID: 219794 IUPAC Name: 5-hydroxyoctan-4-one SMILES: CCCC(O)C(=O)CCC
| PubChem CID | 219794 |
|---|---|
| CAS | 496-77-5 |
| Molecular Weight (g/mol) | 144.21 |
| MDL Number | MFCD00021928 |
| SMILES | CCCC(O)C(=O)CCC |
| Synonym | butyroin,5-hydroxy-4-octanone,4-octanone, 5-hydroxy,5-octanol-4-one,octan-4-ol-5-one,fema no. 2587,5-hydroxy-octan-4-one,acmc-1aijr,ksc236m9n,+/--5-hydroxy-4-octanone |
| IUPAC Name | 5-hydroxyoctan-4-one |
| InChI Key | BVEYJWQCMOVMAR-UHFFFAOYNA-N |
| Molecular Formula | C8H16O2 |
2-Formylthiazole 97.0+%, TCI America™
CAS: 10200-59-6 Molecular Formula: C4H3NOS Molecular Weight (g/mol): 113.134 MDL Number: MFCD00142924 InChI Key: ZGTFNNUASMWGTM-UHFFFAOYSA-N Synonym: 2-thiazolecarboxaldehyde,thiazole-2-carbaldehyde,2-formylthiazole,thiazole-2-carboxaldehyde,2-formyl thiazole,thiazolecarboxaldehyde,2-formyl-1,3-thiazole,1,3-thiazole-2-carboxaldehyde,2-thiazolecarbaldehyde,pubchem9929 PubChem CID: 2734903 ChEBI: CHEBI:43623 IUPAC Name: 1,3-thiazole-2-carbaldehyde SMILES: C1=CSC(=N1)C=O
| PubChem CID | 2734903 |
|---|---|
| CAS | 10200-59-6 |
| Molecular Weight (g/mol) | 113.134 |
| ChEBI | CHEBI:43623 |
| MDL Number | MFCD00142924 |
| SMILES | C1=CSC(=N1)C=O |
| Synonym | 2-thiazolecarboxaldehyde,thiazole-2-carbaldehyde,2-formylthiazole,thiazole-2-carboxaldehyde,2-formyl thiazole,thiazolecarboxaldehyde,2-formyl-1,3-thiazole,1,3-thiazole-2-carboxaldehyde,2-thiazolecarbaldehyde,pubchem9929 |
| IUPAC Name | 1,3-thiazole-2-carbaldehyde |
| InChI Key | ZGTFNNUASMWGTM-UHFFFAOYSA-N |
| Molecular Formula | C4H3NOS |
2'-Acetoxyacetophenone 98.0+%, TCI America™
CAS: 7250-94-4 Molecular Formula: C10H10O3 Molecular Weight (g/mol): 178.19 MDL Number: MFCD00017223 InChI Key: WWEDAIJJBDFOOK-UHFFFAOYSA-N Synonym: 2'-acetoxyacetophenone,2-acetylphenyl acetate,ethanone, 1-2-acetyloxy phenyl,o-acetoxyacetophenone,2'-acetoxy acetophenone,maybridge1_002653,acmc-209on8,acetic acid 2-acetyl-phenyl ester,acetophenone, 2-hydroxy-, acetate 8ci PubChem CID: 16716 IUPAC Name: 2-acetylphenyl acetate SMILES: CC(=O)OC1=CC=CC=C1C(C)=O
| PubChem CID | 16716 |
|---|---|
| CAS | 7250-94-4 |
| Molecular Weight (g/mol) | 178.19 |
| MDL Number | MFCD00017223 |
| SMILES | CC(=O)OC1=CC=CC=C1C(C)=O |
| Synonym | 2'-acetoxyacetophenone,2-acetylphenyl acetate,ethanone, 1-2-acetyloxy phenyl,o-acetoxyacetophenone,2'-acetoxy acetophenone,maybridge1_002653,acmc-209on8,acetic acid 2-acetyl-phenyl ester,acetophenone, 2-hydroxy-, acetate 8ci |
| IUPAC Name | 2-acetylphenyl acetate |
| InChI Key | WWEDAIJJBDFOOK-UHFFFAOYSA-N |
| Molecular Formula | C10H10O3 |
(S,S)-(-)-Hydrobenzoin 99.0+%, TCI America™
CAS: 2325-10-2 Molecular Formula: C14H14O2 Molecular Weight (g/mol): 214.26 MDL Number: MFCD00064255 InChI Key: IHPDTPWNFBQHEB-KBPBESRZSA-N Synonym: s,s---hydrobenzoin,1s,2s-1,2-diphenylethane-1,2-diol,s,s-hydrobenzoin,s,s---1,2-diphenyl-1,2-ethanediol,hydrobenzoin,-,unii-wx45q7714b,1,2-ethanediol, 1,2-diphenyl-, 1s,2s,s,s-1,2-diphenylethylene glycol,1s,2s---1,2-diphenyl-1,2-ethanediol,isohydrobenzoin PubChem CID: 853020 IUPAC Name: (1S,2S)-1,2-diphenylethane-1,2-diol SMILES: C1=CC=C(C=C1)C(C(C2=CC=CC=C2)O)O
| PubChem CID | 853020 |
|---|---|
| CAS | 2325-10-2 |
| Molecular Weight (g/mol) | 214.26 |
| MDL Number | MFCD00064255 |
| SMILES | C1=CC=C(C=C1)C(C(C2=CC=CC=C2)O)O |
| Synonym | s,s---hydrobenzoin,1s,2s-1,2-diphenylethane-1,2-diol,s,s-hydrobenzoin,s,s---1,2-diphenyl-1,2-ethanediol,hydrobenzoin,-,unii-wx45q7714b,1,2-ethanediol, 1,2-diphenyl-, 1s,2s,s,s-1,2-diphenylethylene glycol,1s,2s---1,2-diphenyl-1,2-ethanediol,isohydrobenzoin |
| IUPAC Name | (1S,2S)-1,2-diphenylethane-1,2-diol |
| InChI Key | IHPDTPWNFBQHEB-KBPBESRZSA-N |
| Molecular Formula | C14H14O2 |
4'-Bromo-3'-nitroacetophenone 98.0+%, TCI America™
CAS: 18640-58-9 Molecular Formula: C8H6BrNO3 Molecular Weight (g/mol): 244.04 MDL Number: MFCD00016985 InChI Key: YFVOFFKNHQTQQE-UHFFFAOYSA-N Synonym: 1-4-bromo-3-nitrophenyl ethanone,4'-bromo-3'-nitroacetophenone,1-4-bromo-3-nitrophenyl ethan-1-one,4-bromo-3-nitroacetophenone,4-bromo-3'-nitroacetophenone,ethanone, 1-4-bromo-3-nitrophenyl,acmc-209eny,3-nitro-4-bromoacetophenone,4-bromo-3-nitro acetophenone,3'-nitro-4'-bromoacetophenone PubChem CID: 87737 IUPAC Name: 1-(4-bromo-3-nitrophenyl)ethan-1-one SMILES: CC(=O)C1=CC=C(Br)C(=C1)[N+]([O-])=O
| PubChem CID | 87737 |
|---|---|
| CAS | 18640-58-9 |
| Molecular Weight (g/mol) | 244.04 |
| MDL Number | MFCD00016985 |
| SMILES | CC(=O)C1=CC=C(Br)C(=C1)[N+]([O-])=O |
| Synonym | 1-4-bromo-3-nitrophenyl ethanone,4'-bromo-3'-nitroacetophenone,1-4-bromo-3-nitrophenyl ethan-1-one,4-bromo-3-nitroacetophenone,4-bromo-3'-nitroacetophenone,ethanone, 1-4-bromo-3-nitrophenyl,acmc-209eny,3-nitro-4-bromoacetophenone,4-bromo-3-nitro acetophenone,3'-nitro-4'-bromoacetophenone |
| IUPAC Name | 1-(4-bromo-3-nitrophenyl)ethan-1-one |
| InChI Key | YFVOFFKNHQTQQE-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrNO3 |
2,2',4'-Trichloroacetophenone 98.0+%, TCI America™
CAS: 4252-78-2 Molecular Formula: C8H5Cl3O Molecular Weight (g/mol): 223.477 MDL Number: MFCD00000934 InChI Key: VYWPPRLJNVHPEU-UHFFFAOYSA-N Synonym: 2,2',4'-trichloroacetophenone,2-chloro-1-2,4-dichlorophenyl ethanone,2,4-dichlorophenacyl chloride,unii-2e35p7hji2,2-chloro-1-2,4-dichlorophenyl ethan-1-one,ccris 633,ethanone, 2-chloro-1-2,4-dichlorophenyl,2,2,4-trichloroacetophenone,dsstox_cid_6190,1-2,4-dichlorophenyl-2-chloroethan-1-one PubChem CID: 20250 IUPAC Name: 2-chloro-1-(2,4-dichlorophenyl)ethanone SMILES: C1=CC(=C(C=C1Cl)Cl)C(=O)CCl
| PubChem CID | 20250 |
|---|---|
| CAS | 4252-78-2 |
| Molecular Weight (g/mol) | 223.477 |
| MDL Number | MFCD00000934 |
| SMILES | C1=CC(=C(C=C1Cl)Cl)C(=O)CCl |
| Synonym | 2,2',4'-trichloroacetophenone,2-chloro-1-2,4-dichlorophenyl ethanone,2,4-dichlorophenacyl chloride,unii-2e35p7hji2,2-chloro-1-2,4-dichlorophenyl ethan-1-one,ccris 633,ethanone, 2-chloro-1-2,4-dichlorophenyl,2,2,4-trichloroacetophenone,dsstox_cid_6190,1-2,4-dichlorophenyl-2-chloroethan-1-one |
| IUPAC Name | 2-chloro-1-(2,4-dichlorophenyl)ethanone |
| InChI Key | VYWPPRLJNVHPEU-UHFFFAOYSA-N |
| Molecular Formula | C8H5Cl3O |
2,4,6-Trichloro-5-pyrimidinecarboxaldehyde 98.0+%, TCI America™
CAS: 50270-27-4 Molecular Formula: C5HCl3N2O Molecular Weight (g/mol): 211.426 MDL Number: MFCD02257700 InChI Key: KVJIRFGNHAAUNQ-UHFFFAOYSA-N Synonym: 2,4,6-trichloro-5-pyrimidinecarboxaldehyde,2,4,6-trichloro-pyrimidine-5-carbaldehyde,2,4,6-trichloro-5-formylpyrimidine,5-formyl-2,4,6-trichloropyrimidine,2,4,6-trichloro-pyrimidine-5-carbal,2,4,6-trichloropyrimidine-5-carboxaldehyde,5-pyrimidinecarboxaldehyde, 2,4,6-trichloro,5-pyrimidinecarboxaldehyde,2,4,6-trichloro,pubchem13189,2,4,6-tri-chloropyrimidine-5-carbaldehyde PubChem CID: 10932746 IUPAC Name: 2,4,6-trichloropyrimidine-5-carbaldehyde SMILES: C(=O)C1=C(N=C(N=C1Cl)Cl)Cl
| PubChem CID | 10932746 |
|---|---|
| CAS | 50270-27-4 |
| Molecular Weight (g/mol) | 211.426 |
| MDL Number | MFCD02257700 |
| SMILES | C(=O)C1=C(N=C(N=C1Cl)Cl)Cl |
| Synonym | 2,4,6-trichloro-5-pyrimidinecarboxaldehyde,2,4,6-trichloro-pyrimidine-5-carbaldehyde,2,4,6-trichloro-5-formylpyrimidine,5-formyl-2,4,6-trichloropyrimidine,2,4,6-trichloro-pyrimidine-5-carbal,2,4,6-trichloropyrimidine-5-carboxaldehyde,5-pyrimidinecarboxaldehyde, 2,4,6-trichloro,5-pyrimidinecarboxaldehyde,2,4,6-trichloro,pubchem13189,2,4,6-tri-chloropyrimidine-5-carbaldehyde |
| IUPAC Name | 2,4,6-trichloropyrimidine-5-carbaldehyde |
| InChI Key | KVJIRFGNHAAUNQ-UHFFFAOYSA-N |
| Molecular Formula | C5HCl3N2O |