Organooxygen compounds
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Pivalaldehyde 95.0+%, TCI America™
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 |
|---|---|
| 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 |
alpha-Ionone 90.0+%, TCI America™
CAS: 127-41-3 Molecular Formula: C13H20O Molecular Weight (g/mol): 192.30 MDL Number: MFCD00001565 InChI Key: UZFLPKAIBPNNCA-BQYQJAHWNA-N Synonym: alpha-ionone,iraldeine,e-alpha-ionone,irisone,alpha-ionon,trans-alpha-ionone,alpha-e-ionone,alpha-ionone natural,beta-lonone,ionone, alpha PubChem CID: 5282108 ChEBI: CHEBI:32319 IUPAC Name: (3E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-one SMILES: CC(=O)\C=C\C1C(C)=CCCC1(C)C
| PubChem CID | 5282108 |
|---|---|
| CAS | 127-41-3 |
| Molecular Weight (g/mol) | 192.30 |
| ChEBI | CHEBI:32319 |
| MDL Number | MFCD00001565 |
| SMILES | CC(=O)\C=C\C1C(C)=CCCC1(C)C |
| Synonym | alpha-ionone,iraldeine,e-alpha-ionone,irisone,alpha-ionon,trans-alpha-ionone,alpha-e-ionone,alpha-ionone natural,beta-lonone,ionone, alpha |
| IUPAC Name | (3E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-one |
| InChI Key | UZFLPKAIBPNNCA-BQYQJAHWNA-N |
| Molecular Formula | C13H20O |
Diethylene Glycol Monobutyl Ether 99.0+%, TCI America™
CAS: 112-34-5 Molecular Formula: C8H18O3 Molecular Weight (g/mol): 162.229 MDL Number: MFCD00002881 InChI Key: OAYXUHPQHDHDDZ-UHFFFAOYSA-N Synonym: 2-2-butoxyethoxy ethanol,diethylene glycol monobutyl ether,butyldiglycol,butyl carbitol,diethylene glycol butyl ether,butyl diglycol,butyl digol,ethanol, 2-2-butoxyethoxy,butoxyethoxyethanol,butoxydiglycol PubChem CID: 8177 IUPAC Name: 2-(2-butoxyethoxy)ethanol SMILES: CCCCOCCOCCO
| PubChem CID | 8177 |
|---|---|
| CAS | 112-34-5 |
| Molecular Weight (g/mol) | 162.229 |
| MDL Number | MFCD00002881 |
| SMILES | CCCCOCCOCCO |
| Synonym | 2-2-butoxyethoxy ethanol,diethylene glycol monobutyl ether,butyldiglycol,butyl carbitol,diethylene glycol butyl ether,butyl diglycol,butyl digol,ethanol, 2-2-butoxyethoxy,butoxyethoxyethanol,butoxydiglycol |
| IUPAC Name | 2-(2-butoxyethoxy)ethanol |
| InChI Key | OAYXUHPQHDHDDZ-UHFFFAOYSA-N |
| Molecular Formula | C8H18O3 |
2-Chloroethyl Chloromethyl Ether 98.0+%, TCI America™
CAS: 1462-33-5 Molecular Formula: C3H6Cl2O Molecular Weight (g/mol): 128.98 MDL Number: MFCD00191406 InChI Key: LUTWEKBTDWRTSE-UHFFFAOYSA-N Synonym: 2-(Chloromethoxy)ethyl Chloride PubChem CID: 10290810 IUPAC Name: 1-chloro-2-(chloromethoxy)ethane SMILES: ClCCOCCl
| PubChem CID | 10290810 |
|---|---|
| CAS | 1462-33-5 |
| Molecular Weight (g/mol) | 128.98 |
| MDL Number | MFCD00191406 |
| SMILES | ClCCOCCl |
| Synonym | 2-(Chloromethoxy)ethyl Chloride |
| IUPAC Name | 1-chloro-2-(chloromethoxy)ethane |
| InChI Key | LUTWEKBTDWRTSE-UHFFFAOYSA-N |
| Molecular Formula | C3H6Cl2O |
4'-Chloroacetophenone 97.0+%, TCI America™
CAS: 99-91-2 Molecular Formula: C8H7ClO Molecular Weight (g/mol): 154.59 MDL Number: MFCD00000624 InChI Key: BUZYGTVTZYSBCU-UHFFFAOYSA-N Synonym: 4'-chloroacetophenone,1-4-chlorophenyl ethanone,4-chloroacetophenone,p-chloroacetophenone,ethanone, 1-4-chlorophenyl,acetophenone, 4'-chloro,1-4-chlorophenyl ethan-1-one,4-acetylchlorobenzene,p-chloracetophenone,p-acetylchlorobenzene PubChem CID: 7467 ChEBI: CHEBI:27538 IUPAC Name: 1-(4-chlorophenyl)ethan-1-one SMILES: CC(=O)C1=CC=C(Cl)C=C1
| PubChem CID | 7467 |
|---|---|
| CAS | 99-91-2 |
| Molecular Weight (g/mol) | 154.59 |
| ChEBI | CHEBI:27538 |
| MDL Number | MFCD00000624 |
| SMILES | CC(=O)C1=CC=C(Cl)C=C1 |
| Synonym | 4'-chloroacetophenone,1-4-chlorophenyl ethanone,4-chloroacetophenone,p-chloroacetophenone,ethanone, 1-4-chlorophenyl,acetophenone, 4'-chloro,1-4-chlorophenyl ethan-1-one,4-acetylchlorobenzene,p-chloracetophenone,p-acetylchlorobenzene |
| IUPAC Name | 1-(4-chlorophenyl)ethan-1-one |
| InChI Key | BUZYGTVTZYSBCU-UHFFFAOYSA-N |
| Molecular Formula | C8H7ClO |
1,2-Bis(2-aminoethoxy)ethane 98.0+%, TCI America™
CAS: 929-59-9 Molecular Formula: C6H16N2O2 Molecular Weight (g/mol): 148.206 MDL Number: MFCD00040474 InChI Key: IWBOPFCKHIJFMS-UHFFFAOYSA-N Synonym: 1,8-diamino-3,6-dioxaoctane,1,2-bis 2-aminoethoxy ethane,2,2'-ethylenedioxy bis ethylamine,unii-r41zt4uf34,2,2'-ethane-1,2-diylbis oxy diethanamine,3,6-dioxaoctamethylenediamine,2-2-2-aminoethoxy ethoxy ethanamine,3,6-dioxaoctane-1,8-diamine,ethylene glycol bis 2-aminoethyl ether PubChem CID: 70248 IUPAC Name: 2-[2-(2-aminoethoxy)ethoxy]ethanamine SMILES: C(COCCOCCN)N
| PubChem CID | 70248 |
|---|---|
| CAS | 929-59-9 |
| Molecular Weight (g/mol) | 148.206 |
| MDL Number | MFCD00040474 |
| SMILES | C(COCCOCCN)N |
| Synonym | 1,8-diamino-3,6-dioxaoctane,1,2-bis 2-aminoethoxy ethane,2,2'-ethylenedioxy bis ethylamine,unii-r41zt4uf34,2,2'-ethane-1,2-diylbis oxy diethanamine,3,6-dioxaoctamethylenediamine,2-2-2-aminoethoxy ethoxy ethanamine,3,6-dioxaoctane-1,8-diamine,ethylene glycol bis 2-aminoethyl ether |
| IUPAC Name | 2-[2-(2-aminoethoxy)ethoxy]ethanamine |
| InChI Key | IWBOPFCKHIJFMS-UHFFFAOYSA-N |
| Molecular Formula | C6H16N2O2 |
1-Methoxy-2-propanol 98.0+%, TCI America™
CAS: 107-98-2 Molecular Formula: C4H10O2 Molecular Weight (g/mol): 90.12 MDL Number: MFCD00004537 InChI Key: ARXJGSRGQADJSQ-UHFFFAOYNA-N Synonym: 1-methoxy-2-propanol,pgme,methoxyisopropanol,2-propanol, 1-methoxy,closol,dowtherm 209,propylene glycol monomethyl ether,poly-solve mpm,propasol solvent m,dowanol 33b PubChem CID: 7900 IUPAC Name: 1-methoxypropan-2-ol SMILES: COCC(C)O
| PubChem CID | 7900 |
|---|---|
| CAS | 107-98-2 |
| Molecular Weight (g/mol) | 90.12 |
| MDL Number | MFCD00004537 |
| SMILES | COCC(C)O |
| Synonym | 1-methoxy-2-propanol,pgme,methoxyisopropanol,2-propanol, 1-methoxy,closol,dowtherm 209,propylene glycol monomethyl ether,poly-solve mpm,propasol solvent m,dowanol 33b |
| IUPAC Name | 1-methoxypropan-2-ol |
| InChI Key | ARXJGSRGQADJSQ-UHFFFAOYNA-N |
| Molecular Formula | C4H10O2 |
Ethyl 3-Ethoxypropionate 99.0+%, TCI America™
CAS: 763-69-9 Molecular Formula: C7H14O3 Molecular Weight (g/mol): 146.186 MDL Number: MFCD00051356 InChI Key: BHXIWUJLHYHGSJ-UHFFFAOYSA-N Synonym: ethyl 3-ethoxypropionate,3-ethoxypropionic acid ethyl ester,propanoic acid, 3-ethoxy-, ethyl ester,eep solvent,ethoxypropionic acid, ethyl ester,ethyl beta-ethoxypropionate,unii-ec38rsj79j,propionic acid, 3-ethoxy-, ethyl ester,ethyl-3-ethoxypropionate,ethylester kyseliny 3-ethoxypropionove PubChem CID: 12989 IUPAC Name: ethyl 3-ethoxypropanoate SMILES: CCOCCC(=O)OCC
| PubChem CID | 12989 |
|---|---|
| CAS | 763-69-9 |
| Molecular Weight (g/mol) | 146.186 |
| MDL Number | MFCD00051356 |
| SMILES | CCOCCC(=O)OCC |
| Synonym | ethyl 3-ethoxypropionate,3-ethoxypropionic acid ethyl ester,propanoic acid, 3-ethoxy-, ethyl ester,eep solvent,ethoxypropionic acid, ethyl ester,ethyl beta-ethoxypropionate,unii-ec38rsj79j,propionic acid, 3-ethoxy-, ethyl ester,ethyl-3-ethoxypropionate,ethylester kyseliny 3-ethoxypropionove |
| IUPAC Name | ethyl 3-ethoxypropanoate |
| InChI Key | BHXIWUJLHYHGSJ-UHFFFAOYSA-N |
| Molecular Formula | C7H14O3 |
Amyl Ether 98.0+%, TCI America™
CAS: 693-65-2 Molecular Formula: C10H22O Molecular Weight (g/mol): 158.285 MDL Number: MFCD00009501 InChI Key: AOPDRZXCEAKHHW-UHFFFAOYSA-N Synonym: dipentyl ether,amyl ether,pentyl ether,n-amyl ether,diamyl ether,pentane, 1,1'-oxybis,n-pentyl ether,di-n-pentyl ether,pentyloxypentane,di-n-amyl ether PubChem CID: 12743 IUPAC Name: 1-pentoxypentane SMILES: CCCCCOCCCCC
| PubChem CID | 12743 |
|---|---|
| CAS | 693-65-2 |
| Molecular Weight (g/mol) | 158.285 |
| MDL Number | MFCD00009501 |
| SMILES | CCCCCOCCCCC |
| Synonym | dipentyl ether,amyl ether,pentyl ether,n-amyl ether,diamyl ether,pentane, 1,1'-oxybis,n-pentyl ether,di-n-pentyl ether,pentyloxypentane,di-n-amyl ether |
| IUPAC Name | 1-pentoxypentane |
| InChI Key | AOPDRZXCEAKHHW-UHFFFAOYSA-N |
| Molecular Formula | C10H22O |
1,2-Bis(2-chloroethoxy)ethane 98.0+%, TCI America™
CAS: 112-26-5 Molecular Formula: C6H12Cl2O2 Molecular Weight (g/mol): 187.06 MDL Number: MFCD00000976 InChI Key: AGYUOJIYYGGHKV-UHFFFAOYSA-N Synonym: 1,2-bis 2-chloroethoxy ethane,triglycol dichloride,triethylene glycol dichloride,ethane, 1,2-bis 2-chloroethoxy,1,8-dichloro-3,6-dioxaoctane,1,2-bis chloroethoxy ethane,bis 2-chloroethoxy ethane,di 2-chloroethyl cellosolve,2-2-chloroethoxy ethyl 2'-chloroethyl ether,unii-28jq82m13j PubChem CID: 8171 IUPAC Name: 1-chloro-2-[2-(2-chloroethoxy)ethoxy]ethane SMILES: ClCCOCCOCCCl
| PubChem CID | 8171 |
|---|---|
| CAS | 112-26-5 |
| Molecular Weight (g/mol) | 187.06 |
| MDL Number | MFCD00000976 |
| SMILES | ClCCOCCOCCCl |
| Synonym | 1,2-bis 2-chloroethoxy ethane,triglycol dichloride,triethylene glycol dichloride,ethane, 1,2-bis 2-chloroethoxy,1,8-dichloro-3,6-dioxaoctane,1,2-bis chloroethoxy ethane,bis 2-chloroethoxy ethane,di 2-chloroethyl cellosolve,2-2-chloroethoxy ethyl 2'-chloroethyl ether,unii-28jq82m13j |
| IUPAC Name | 1-chloro-2-[2-(2-chloroethoxy)ethoxy]ethane |
| InChI Key | AGYUOJIYYGGHKV-UHFFFAOYSA-N |
| Molecular Formula | C6H12Cl2O2 |
6-Bromo-3-pyridinecarboxaldehyde 98.0+%, TCI America™
CAS: 149806-06-4 Molecular Formula: C6H4BrNO Molecular Weight (g/mol): 186.01 MDL Number: MFCD04115419 InChI Key: PVUKGNBRJFTFNJ-UHFFFAOYSA-N Synonym: 6-bromonicotinaldehyde,2-bromo-5-formylpyridine,2-bromopyridine-5-carbaldehyde,6-bromo-3-pyridinecarboxaldehyde,2-bromopyridine-5-carboxaldehyde,3-pyridinecarboxaldehyde, 6-bromo,6-bromo-pyridine-3-carbaldehyde,6-bromopyridine-3-carboxaldehyde,2-bromo-5-pyridinecarbaldehyde,6-bromo-3-formylpyridine PubChem CID: 11769234 IUPAC Name: 6-bromopyridine-3-carbaldehyde SMILES: BrC1=CC=C(C=O)C=N1
| PubChem CID | 11769234 |
|---|---|
| CAS | 149806-06-4 |
| Molecular Weight (g/mol) | 186.01 |
| MDL Number | MFCD04115419 |
| SMILES | BrC1=CC=C(C=O)C=N1 |
| Synonym | 6-bromonicotinaldehyde,2-bromo-5-formylpyridine,2-bromopyridine-5-carbaldehyde,6-bromo-3-pyridinecarboxaldehyde,2-bromopyridine-5-carboxaldehyde,3-pyridinecarboxaldehyde, 6-bromo,6-bromo-pyridine-3-carbaldehyde,6-bromopyridine-3-carboxaldehyde,2-bromo-5-pyridinecarbaldehyde,6-bromo-3-formylpyridine |
| IUPAC Name | 6-bromopyridine-3-carbaldehyde |
| InChI Key | PVUKGNBRJFTFNJ-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrNO |
Butyroin, 97%
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 |
1-Octen-3-one, 97%, stab. with 0.1% BHA
CAS: 4312-99-6 Molecular Formula: C8H14O Molecular Weight (g/mol): 126.199 MDL Number: MFCD00036558 InChI Key: KLTVSWGXIAYTHO-UHFFFAOYSA-N Synonym: 1-octen-3-one,vinyl amyl ketone,amyl vinyl ketone,pentyl vinyl ketone,unii-7lt7z4q9xr,1-octene-3-one,fema no. 3515,7lt7z4q9xr,n-pentyl vinyl ketone,octen-3-one, 1 PubChem CID: 61346 IUPAC Name: oct-1-en-3-one SMILES: CCCCCC(=O)C=C
| PubChem CID | 61346 |
|---|---|
| CAS | 4312-99-6 |
| Molecular Weight (g/mol) | 126.199 |
| MDL Number | MFCD00036558 |
| SMILES | CCCCCC(=O)C=C |
| Synonym | 1-octen-3-one,vinyl amyl ketone,amyl vinyl ketone,pentyl vinyl ketone,unii-7lt7z4q9xr,1-octene-3-one,fema no. 3515,7lt7z4q9xr,n-pentyl vinyl ketone,octen-3-one, 1 |
| IUPAC Name | oct-1-en-3-one |
| InChI Key | KLTVSWGXIAYTHO-UHFFFAOYSA-N |
| Molecular Formula | C8H14O |
4-Amino-3-penten-2-one, 96%
CAS: 1118-66-7 Molecular Formula: C5H9NO Molecular Weight (g/mol): 99.133 MDL Number: MFCD00043715 InChI Key: OSLAYKKXCYSJSF-ONEGZZNKSA-N Synonym: acetylacetonamine,fluoral-p,4-amino-3-penten-2-one,e-4-aminopent-3-en-2-one,3-penten-2-one, 4-amino,3e-4-aminopent-3-en-2-one,4-aminopent-3-en-2-one,4-amino-pent-3-en-2-one,e-4-amino-3-pentene-2-one,2-acetyl-1-amino-1-methylethylene PubChem CID: 5367854 ChEBI: CHEBI:51695 IUPAC Name: (E)-4-aminopent-3-en-2-one SMILES: CC(=CC(=O)C)N
| PubChem CID | 5367854 |
|---|---|
| CAS | 1118-66-7 |
| Molecular Weight (g/mol) | 99.133 |
| ChEBI | CHEBI:51695 |
| MDL Number | MFCD00043715 |
| SMILES | CC(=CC(=O)C)N |
| Synonym | acetylacetonamine,fluoral-p,4-amino-3-penten-2-one,e-4-aminopent-3-en-2-one,3-penten-2-one, 4-amino,3e-4-aminopent-3-en-2-one,4-aminopent-3-en-2-one,4-amino-pent-3-en-2-one,e-4-amino-3-pentene-2-one,2-acetyl-1-amino-1-methylethylene |
| IUPAC Name | (E)-4-aminopent-3-en-2-one |
| InChI Key | OSLAYKKXCYSJSF-ONEGZZNKSA-N |
| Molecular Formula | C5H9NO |
Crotonaldehyde, predominantly trans, 98+%
CAS: 4170-30-3 Molecular Formula: C4H6O Molecular Weight (g/mol): 70.091 MDL Number: MFCD00007003 InChI Key: MLUCVPSAIODCQM-NSCUHMNNSA-N Synonym: crotonaldehyde,2-butenal,crotylaldehyde,crotonal,2e-but-2-enal,trans-crotonaldehyde,e-crotonaldehyde,crotonic aldehyde,1-formylpropene,trans-2-butenal PubChem CID: 447466 ChEBI: CHEBI:41607 IUPAC Name: (E)-but-2-enal SMILES: CC=CC=O
| PubChem CID | 447466 |
|---|---|
| CAS | 4170-30-3 |
| Molecular Weight (g/mol) | 70.091 |
| ChEBI | CHEBI:41607 |
| MDL Number | MFCD00007003 |
| SMILES | CC=CC=O |
| Synonym | crotonaldehyde,2-butenal,crotylaldehyde,crotonal,2e-but-2-enal,trans-crotonaldehyde,e-crotonaldehyde,crotonic aldehyde,1-formylpropene,trans-2-butenal |
| IUPAC Name | (E)-but-2-enal |
| InChI Key | MLUCVPSAIODCQM-NSCUHMNNSA-N |
| Molecular Formula | C4H6O |