Organic acids and derivatives
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Diethyl 4-methylbenzylphosphonate, 98+%
CAS: 3762-25-2 Molecular Formula: C12H19O3P Molecular Weight (g/mol): 242.255 MDL Number: MFCD00041385 InChI Key: QKGBKPZAXXBLJE-UHFFFAOYSA-N Synonym: diethyl 4-methylbenzylphosphonate,diethyl 4-methylbenzyl phosphonate,4-methylbenzyl phosphonic acid diethyl ester,diethyl 4-methylphenyl methylphosphonate,diethoxy 4-methylphenyl methyl phosphino-1-one,acmc-209iuf,diethyl-4-methylbenzylphosphonate,1-diethoxyphosphorylmethyl-4-methylbenzene,phosphonic acid, 4-methylphenyl methyl-, diethyl ester PubChem CID: 3050 IUPAC Name: 1-(diethoxyphosphorylmethyl)-4-methylbenzene SMILES: CCOP(=O)(CC1=CC=C(C=C1)C)OCC
| PubChem CID | 3050 |
|---|---|
| CAS | 3762-25-2 |
| Molecular Weight (g/mol) | 242.255 |
| MDL Number | MFCD00041385 |
| SMILES | CCOP(=O)(CC1=CC=C(C=C1)C)OCC |
| Synonym | diethyl 4-methylbenzylphosphonate,diethyl 4-methylbenzyl phosphonate,4-methylbenzyl phosphonic acid diethyl ester,diethyl 4-methylphenyl methylphosphonate,diethoxy 4-methylphenyl methyl phosphino-1-one,acmc-209iuf,diethyl-4-methylbenzylphosphonate,1-diethoxyphosphorylmethyl-4-methylbenzene,phosphonic acid, 4-methylphenyl methyl-, diethyl ester |
| IUPAC Name | 1-(diethoxyphosphorylmethyl)-4-methylbenzene |
| InChI Key | QKGBKPZAXXBLJE-UHFFFAOYSA-N |
| Molecular Formula | C12H19O3P |
Diethyl 1-propylphosphonate, 97%, Thermo Scientific Chemicals
CAS: 18812-51-6 Molecular Formula: C7H17O3P Molecular Weight (g/mol): 180.184 MDL Number: MFCD00015139 InChI Key: RUIKOPXSCCGLOM-UHFFFAOYSA-N Synonym: diethyl propylphosphonate,diethyl propanephosphonate,diethyl 1-propylphosphonate,phosphonic acid, propyl-, diethyl ester,diethyl 1-propanephosphonate,diethyl-n-propylphosphonate,diethoxypropylphosphine oxide,acmc-20al9i,diethyl n-propylphosphonate,1-diethoxyphosphoryl-propane PubChem CID: 140428 IUPAC Name: 1-diethoxyphosphorylpropane SMILES: CCCP(=O)(OCC)OCC
| PubChem CID | 140428 |
|---|---|
| CAS | 18812-51-6 |
| Molecular Weight (g/mol) | 180.184 |
| MDL Number | MFCD00015139 |
| SMILES | CCCP(=O)(OCC)OCC |
| Synonym | diethyl propylphosphonate,diethyl propanephosphonate,diethyl 1-propylphosphonate,phosphonic acid, propyl-, diethyl ester,diethyl 1-propanephosphonate,diethyl-n-propylphosphonate,diethoxypropylphosphine oxide,acmc-20al9i,diethyl n-propylphosphonate,1-diethoxyphosphoryl-propane |
| IUPAC Name | 1-diethoxyphosphorylpropane |
| InChI Key | RUIKOPXSCCGLOM-UHFFFAOYSA-N |
| Molecular Formula | C7H17O3P |
Hydroxychloroquine sulfate, 98%
CAS: 747-36-4 Molecular Formula: C18H26ClN3O·H2SO4 Molecular Weight (g/mol): 433.96 MDL Number: MFCD00078203 InChI Key: JCBIVZZPXRZKTI-UHFFFAOYSA-N Synonym: hydroxychloroquine sulfate,hydroxychloroquine sulphate,ercoquin,plaquinol,toremonil,2-4-7-chloroquinolin-4-yl amino pentyl ethyl amino ethanol sulfate,hydroxychloroquine sulfate usp,plaquenil tn,hydroxychloroquine; sulfuric acid,dsstox_cid_27788 PubChem CID: 12947 IUPAC Name: 2-[4-[(7-chloroquinolin-4-yl)amino]pentyl-ethylamino]ethanol;sulfuric acid SMILES: CCN(CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl)CCO.OS(=O)(=O)O
| PubChem CID | 12947 |
|---|---|
| CAS | 747-36-4 |
| Molecular Weight (g/mol) | 433.96 |
| MDL Number | MFCD00078203 |
| SMILES | CCN(CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl)CCO.OS(=O)(=O)O |
| Synonym | hydroxychloroquine sulfate,hydroxychloroquine sulphate,ercoquin,plaquinol,toremonil,2-4-7-chloroquinolin-4-yl amino pentyl ethyl amino ethanol sulfate,hydroxychloroquine sulfate usp,plaquenil tn,hydroxychloroquine; sulfuric acid,dsstox_cid_27788 |
| IUPAC Name | 2-[4-[(7-chloroquinolin-4-yl)amino]pentyl-ethylamino]ethanol;sulfuric acid |
| InChI Key | JCBIVZZPXRZKTI-UHFFFAOYSA-N |
| Molecular Formula | C18H26ClN3O·H2SO4 |
Sodium n-octyl sulfate, 99%
CAS: 142-31-4 Molecular Formula: C8H17NaO4S Molecular Weight (g/mol): 232.27 MDL Number: MFCD00007470 InChI Key: WFRKJMRGXGWHBM-UHFFFAOYSA-M Synonym: sodium octyl sulfate,sodium n-octyl sulfate,sodium octyl sulphate,sipex ols,cycloryl os,duponol 80,sodium capryl sulfate,octyl sodium sulfate,sulfuric acid, monooctyl ester, sodium salt,octyl sulfate sodium salt PubChem CID: 2735107 IUPAC Name: sodium;octyl sulfate SMILES: CCCCCCCCOS(=O)(=O)[O-].[Na+]
| PubChem CID | 2735107 |
|---|---|
| CAS | 142-31-4 |
| Molecular Weight (g/mol) | 232.27 |
| MDL Number | MFCD00007470 |
| SMILES | CCCCCCCCOS(=O)(=O)[O-].[Na+] |
| Synonym | sodium octyl sulfate,sodium n-octyl sulfate,sodium octyl sulphate,sipex ols,cycloryl os,duponol 80,sodium capryl sulfate,octyl sodium sulfate,sulfuric acid, monooctyl ester, sodium salt,octyl sulfate sodium salt |
| IUPAC Name | sodium;octyl sulfate |
| InChI Key | WFRKJMRGXGWHBM-UHFFFAOYSA-M |
| Molecular Formula | C8H17NaO4S |
Beryllium Sulfate, Tetrahydrate, Spectrum™ Chemical
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CAS: 7787-56-6
| CAS | 7787-56-6 |
|---|
kappa-Carrageenan
CAS: 11114-20-8 Molecular Formula: C24H36O25S2-2 Molecular Weight (g/mol): 788.647 MDL Number: MFCD00151514 InChI Key: ZNOZWUKQPJXOIG-XSBHQQIPSA-L Synonym: kappa-carrageenan,kappa-carrageenans,1->4-3,6-anhydro-alpha-d-galactopyranosyl-1->3-4-o-sulfonato-beta-d-galactopyranan PubChem CID: 11966249 IUPAC Name: [(2R,3S,4R,5R,6S)-6-[[(1R,3S,4R,5R,8S)-3,4-dihydroxy-2,6-dioxabicyclo[3.2.1]octan-8-yl]oxy]-4-[[(1R,3R,4R,5R,8S)-8-[(2S,3R,4R,5R,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-sulfonatooxyoxan-2-yl]oxy-4-hydroxy-2,6-dioxabicyclo[3.2.1]octan-3-yl]oxy]-5-hydroxy-2-( SMILES: C1C2C(C(O1)C(C(O2)O)O)OC3C(C(C(C(O3)CO)OS(=O)(=O)[O-])OC4C(C5C(C(O4)CO5)OC6C(C(C(C(O6)CO)OS(=O)(=O)[O-])O)O)O)O
| PubChem CID | 11966249 |
|---|---|
| CAS | 11114-20-8 |
| Molecular Weight (g/mol) | 788.647 |
| MDL Number | MFCD00151514 |
| SMILES | C1C2C(C(O1)C(C(O2)O)O)OC3C(C(C(C(O3)CO)OS(=O)(=O)[O-])OC4C(C5C(C(O4)CO5)OC6C(C(C(C(O6)CO)OS(=O)(=O)[O-])O)O)O)O |
| Synonym | kappa-carrageenan,kappa-carrageenans,1->4-3,6-anhydro-alpha-d-galactopyranosyl-1->3-4-o-sulfonato-beta-d-galactopyranan |
| IUPAC Name | [(2R,3S,4R,5R,6S)-6-[[(1R,3S,4R,5R,8S)-3,4-dihydroxy-2,6-dioxabicyclo[3.2.1]octan-8-yl]oxy]-4-[[(1R,3R,4R,5R,8S)-8-[(2S,3R,4R,5R,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-sulfonatooxyoxan-2-yl]oxy-4-hydroxy-2,6-dioxabicyclo[3.2.1]octan-3-yl]oxy]-5-hydroxy-2-( |
| InChI Key | ZNOZWUKQPJXOIG-XSBHQQIPSA-L |
| Molecular Formula | C24H36O25S2-2 |
Ethyl 2-bromovalerate, 97%
CAS: 615-83-8 Molecular Formula: C7H13BrO2 Molecular Weight (g/mol): 209.083 MDL Number: MFCD00000159 InChI Key: ORSIRXYHFPHWTN-UHFFFAOYSA-N PubChem CID: 79071 IUPAC Name: ethyl 2-bromopentanoate SMILES: CCCC(C(=O)OCC)Br
| PubChem CID | 79071 |
|---|---|
| CAS | 615-83-8 |
| Molecular Weight (g/mol) | 209.083 |
| MDL Number | MFCD00000159 |
| SMILES | CCCC(C(=O)OCC)Br |
| IUPAC Name | ethyl 2-bromopentanoate |
| InChI Key | ORSIRXYHFPHWTN-UHFFFAOYSA-N |
| Molecular Formula | C7H13BrO2 |
Sodium trichloroacetate, 97%
CAS: 650-51-1 Molecular Formula: C2Cl3NaO2 Molecular Weight (g/mol): 185.36 MDL Number: MFCD00064198 InChI Key: SAQSTQBVENFSKT-UHFFFAOYSA-M Synonym: sodium trichloroacetate,tca-sodium,trichloroacetic acid sodium salt,antiperz,antyperz,tca sodium,acp grass killer,sodium tca,varitox,stca PubChem CID: 23681045 ChEBI: CHEBI:81976 IUPAC Name: sodium;2,2,2-trichloroacetate SMILES: C(=O)(C(Cl)(Cl)Cl)[O-].[Na+]
| PubChem CID | 23681045 |
|---|---|
| CAS | 650-51-1 |
| Molecular Weight (g/mol) | 185.36 |
| ChEBI | CHEBI:81976 |
| MDL Number | MFCD00064198 |
| SMILES | C(=O)(C(Cl)(Cl)Cl)[O-].[Na+] |
| Synonym | sodium trichloroacetate,tca-sodium,trichloroacetic acid sodium salt,antiperz,antyperz,tca sodium,acp grass killer,sodium tca,varitox,stca |
| IUPAC Name | sodium;2,2,2-trichloroacetate |
| InChI Key | SAQSTQBVENFSKT-UHFFFAOYSA-M |
| Molecular Formula | C2Cl3NaO2 |
2-Fluoroisobutyric acid, 95%
CAS: 63812-15-7 Molecular Formula: C4H7FO2 Molecular Weight (g/mol): 106.096 MDL Number: MFCD03452788 InChI Key: NZDOWZQRNZLBOY-UHFFFAOYSA-N Synonym: 2-fluoroisobutyric acid,2-fluoroisobutanoic acid,2-fluoro-2-methyl-propanoic acid,2-fluoro-2-methylpropionic acid,fluoroisobutyric acid,acmc-1b6kg,2-methyl-2-fluoropropionic acid,2-fluoro-2-methyl-propionic acid,2-fluoranyl-2-methyl-propanoic acid,propanoic acid, 2-fluoro-2-methyl PubChem CID: 2782828 IUPAC Name: 2-fluoro-2-methylpropanoic acid SMILES: CC(C)(C(=O)O)F
| PubChem CID | 2782828 |
|---|---|
| CAS | 63812-15-7 |
| Molecular Weight (g/mol) | 106.096 |
| MDL Number | MFCD03452788 |
| SMILES | CC(C)(C(=O)O)F |
| Synonym | 2-fluoroisobutyric acid,2-fluoroisobutanoic acid,2-fluoro-2-methyl-propanoic acid,2-fluoro-2-methylpropionic acid,fluoroisobutyric acid,acmc-1b6kg,2-methyl-2-fluoropropionic acid,2-fluoro-2-methyl-propionic acid,2-fluoranyl-2-methyl-propanoic acid,propanoic acid, 2-fluoro-2-methyl |
| IUPAC Name | 2-fluoro-2-methylpropanoic acid |
| InChI Key | NZDOWZQRNZLBOY-UHFFFAOYSA-N |
| Molecular Formula | C4H7FO2 |
2,2-Difluoropropionic acid, 97%, Thermo Scientific Chemicals
CAS: 373-96-6 Molecular Formula: C3H4F2O2 Molecular Weight (g/mol): 110.06 MDL Number: MFCD03093764 InChI Key: PMWGIVRHUIAIII-UHFFFAOYSA-N Synonym: 2,2-difluoropropionic acid,2,2-difluoropropionicacid,2,2-difluoro-propionic acid,propanoic acid, 2,2-difluoro,acmc-1ctsu,2,2-difluorpropionic acid PubChem CID: 2782825 IUPAC Name: 2,2-difluoropropanoic acid SMILES: CC(F)(F)C(O)=O
| PubChem CID | 2782825 |
|---|---|
| CAS | 373-96-6 |
| Molecular Weight (g/mol) | 110.06 |
| MDL Number | MFCD03093764 |
| SMILES | CC(F)(F)C(O)=O |
| Synonym | 2,2-difluoropropionic acid,2,2-difluoropropionicacid,2,2-difluoro-propionic acid,propanoic acid, 2,2-difluoro,acmc-1ctsu,2,2-difluorpropionic acid |
| IUPAC Name | 2,2-difluoropropanoic acid |
| InChI Key | PMWGIVRHUIAIII-UHFFFAOYSA-N |
| Molecular Formula | C3H4F2O2 |
Diethyl chloromalonate, 90%
CAS: 14064-10-9 Molecular Formula: C7H11ClO4 Molecular Weight (g/mol): 194.61 InChI Key: WLWCQKMQYZFTDR-UHFFFAOYSA-N Synonym: diethyl chloromalonate,diethyl 2-chloromalonate,ethyl chloromalonate,ethylmonochloromalonate,propanedioic acid, chloro-, diethyl ester,chloromalonic acid, diethyl ester,diethyl chloropropanedioate,malonic acid, chloro-, diethyl ester,1,3-diethyl 2-chloropropanedioate,propanedioic acid, 2-chloro-, 1,3-diethyl ester PubChem CID: 84182 IUPAC Name: diethyl 2-chloropropanedioate SMILES: CCOC(=O)C(C(=O)OCC)Cl
| PubChem CID | 84182 |
|---|---|
| CAS | 14064-10-9 |
| Molecular Weight (g/mol) | 194.61 |
| SMILES | CCOC(=O)C(C(=O)OCC)Cl |
| Synonym | diethyl chloromalonate,diethyl 2-chloromalonate,ethyl chloromalonate,ethylmonochloromalonate,propanedioic acid, chloro-, diethyl ester,chloromalonic acid, diethyl ester,diethyl chloropropanedioate,malonic acid, chloro-, diethyl ester,1,3-diethyl 2-chloropropanedioate,propanedioic acid, 2-chloro-, 1,3-diethyl ester |
| IUPAC Name | diethyl 2-chloropropanedioate |
| InChI Key | WLWCQKMQYZFTDR-UHFFFAOYSA-N |
| Molecular Formula | C7H11ClO4 |
Bromoacetic acid, 98+%
CAS: 79-08-3 Molecular Formula: C2H3BrO2 Molecular Weight (g/mol): 138.95 MDL Number: MFCD00002678 InChI Key: KDPAWGWELVVRCH-UHFFFAOYSA-N Synonym: bromoacetic acid,monobromoacetic acid,bromoethanoic acid,acetic acid, bromo,to ntu,bromoacetate ion,acide bromacetique,2-bromoacetyl group,2-bromoethanoic acid,acetic acid, 2-bromo PubChem CID: 6227 IUPAC Name: 2-bromoacetic acid SMILES: C(C(=O)O)Br
| PubChem CID | 6227 |
|---|---|
| CAS | 79-08-3 |
| Molecular Weight (g/mol) | 138.95 |
| MDL Number | MFCD00002678 |
| SMILES | C(C(=O)O)Br |
| Synonym | bromoacetic acid,monobromoacetic acid,bromoethanoic acid,acetic acid, bromo,to ntu,bromoacetate ion,acide bromacetique,2-bromoacetyl group,2-bromoethanoic acid,acetic acid, 2-bromo |
| IUPAC Name | 2-bromoacetic acid |
| InChI Key | KDPAWGWELVVRCH-UHFFFAOYSA-N |
| Molecular Formula | C2H3BrO2 |
Isopropyl 2-bromo-2-methylpropanoate, 97%, Thermo Scientific™
CAS: 51368-55-9 Molecular Formula: C7H13BrO2 Molecular Weight (g/mol): 209.08 MDL Number: MFCD00055235 InChI Key: UNZJYKKJZGIFCG-UHFFFAOYSA-N Synonym: isopropyl 2-bromo-2-methylpropanoate,isopropyl 2-bromo-2-methylpropionate,2-bromo-2-methylpropionic acid isopropyl ester,isopropyl 2-bromoisobutyrate,propanoic acid, 2-bromo-2-methyl-, 1-methylethyl ester,isopropyl 2-bromo-2-methyl-propanoate,methylethyl 2-bromo-2-methylpropanoate,2-bromo-iso-butyric acid isopropyl ester,propan-2-yl 2-bromanyl-2-methyl-propanoate,2-bromoisobutyric acid isopropyl ester PubChem CID: 2796293 IUPAC Name: propan-2-yl 2-bromo-2-methylpropanoate SMILES: CC(C)OC(=O)C(C)(C)Br
| PubChem CID | 2796293 |
|---|---|
| CAS | 51368-55-9 |
| Molecular Weight (g/mol) | 209.08 |
| MDL Number | MFCD00055235 |
| SMILES | CC(C)OC(=O)C(C)(C)Br |
| Synonym | isopropyl 2-bromo-2-methylpropanoate,isopropyl 2-bromo-2-methylpropionate,2-bromo-2-methylpropionic acid isopropyl ester,isopropyl 2-bromoisobutyrate,propanoic acid, 2-bromo-2-methyl-, 1-methylethyl ester,isopropyl 2-bromo-2-methyl-propanoate,methylethyl 2-bromo-2-methylpropanoate,2-bromo-iso-butyric acid isopropyl ester,propan-2-yl 2-bromanyl-2-methyl-propanoate,2-bromoisobutyric acid isopropyl ester |
| IUPAC Name | propan-2-yl 2-bromo-2-methylpropanoate |
| InChI Key | UNZJYKKJZGIFCG-UHFFFAOYSA-N |
| Molecular Formula | C7H13BrO2 |
Ethyl chloroacetate, 99%
CAS: 105-39-5 MDL Number: MFCD00000932 InChI Key: VEUUMBGHMNQHGO-UHFFFAOYSA-N Synonym: ethyl chloroacetate,ethyl chloracetate,ethyl monochloroacetate,acetic acid, chloro-, ethyl ester,chloroacetic acid ethyl ester,ethyl monochloracetate,ethyl chloroethanoate,ethyl alpha-chloroacetate,2-chloroacetic acid ethyl ester,unii-6h07teh4tf PubChem CID: 7751 IUPAC Name: ethyl 2-chloroacetate SMILES: CCOC(=O)CCl
| PubChem CID | 7751 |
|---|---|
| CAS | 105-39-5 |
| MDL Number | MFCD00000932 |
| SMILES | CCOC(=O)CCl |
| Synonym | ethyl chloroacetate,ethyl chloracetate,ethyl monochloroacetate,acetic acid, chloro-, ethyl ester,chloroacetic acid ethyl ester,ethyl monochloracetate,ethyl chloroethanoate,ethyl alpha-chloroacetate,2-chloroacetic acid ethyl ester,unii-6h07teh4tf |
| IUPAC Name | ethyl 2-chloroacetate |
| InChI Key | VEUUMBGHMNQHGO-UHFFFAOYSA-N |
Iodoacetic acid, 97+%
CAS: 64-69-7 Molecular Formula: C2H3IO2 Molecular Weight (g/mol): 185.948 MDL Number: MFCD00002685 InChI Key: JDNTWHVOXJZDSN-UHFFFAOYSA-N Synonym: iodoacetic acid,acetic acid, iodo,iodoacetate,monoiodoacetic acid,monoiodoacetate,monoiodine acetate,iodoaceticacid,iodoethanoic acid,acetic acid, 2-iodo,kyselina jodoctova PubChem CID: 5240 ChEBI: CHEBI:74571 IUPAC Name: 2-iodoacetic acid SMILES: C(C(=O)O)I
| PubChem CID | 5240 |
|---|---|
| CAS | 64-69-7 |
| Molecular Weight (g/mol) | 185.948 |
| ChEBI | CHEBI:74571 |
| MDL Number | MFCD00002685 |
| SMILES | C(C(=O)O)I |
| Synonym | iodoacetic acid,acetic acid, iodo,iodoacetate,monoiodoacetic acid,monoiodoacetate,monoiodine acetate,iodoaceticacid,iodoethanoic acid,acetic acid, 2-iodo,kyselina jodoctova |
| IUPAC Name | 2-iodoacetic acid |
| InChI Key | JDNTWHVOXJZDSN-UHFFFAOYSA-N |
| Molecular Formula | C2H3IO2 |