Organic acids and derivatives
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Methyl 2,2-dimethyl-3-hydroxypropionate, 98+%
CAS: 14002-80-3 Molecular Formula: C6H12O3 Molecular Weight (g/mol): 132.16 MDL Number: MFCD00009707 InChI Key: KJRFTNVYOAGTHK-UHFFFAOYSA-N Synonym: hydroxypivalic acid methyl ester,methyl 3-hydroxypivalate,methyl hydroxypivalate,methyl 2,2-dimethyl-3-hydroxypropionate,hydroxypivalicacidmethylester,propanoic acid, 3-hydroxy-2,2-dimethyl-, methyl ester,2,2-dimethyl-3-hydroxypropionic acid methyl ester,3-hydroxy-2,2-dimethyl-propionic acid methyl ester,methyl 2,2-dimethyl-3-hydroxypropanoate,methyl hydroxylpivalate PubChem CID: 84152 IUPAC Name: methyl 3-hydroxy-2,2-dimethylpropanoate SMILES: COC(=O)C(C)(C)CO
| PubChem CID | 84152 |
|---|---|
| CAS | 14002-80-3 |
| Molecular Weight (g/mol) | 132.16 |
| MDL Number | MFCD00009707 |
| SMILES | COC(=O)C(C)(C)CO |
| Synonym | hydroxypivalic acid methyl ester,methyl 3-hydroxypivalate,methyl hydroxypivalate,methyl 2,2-dimethyl-3-hydroxypropionate,hydroxypivalicacidmethylester,propanoic acid, 3-hydroxy-2,2-dimethyl-, methyl ester,2,2-dimethyl-3-hydroxypropionic acid methyl ester,3-hydroxy-2,2-dimethyl-propionic acid methyl ester,methyl 2,2-dimethyl-3-hydroxypropanoate,methyl hydroxylpivalate |
| IUPAC Name | methyl 3-hydroxy-2,2-dimethylpropanoate |
| InChI Key | KJRFTNVYOAGTHK-UHFFFAOYSA-N |
| Molecular Formula | C6H12O3 |
1-(tert-Butyl)-3-methyl-1H-pyrazole-5-carboxylic acid, ≥95%, Thermo Scientific™
CAS: 175277-09-5 Molecular Formula: C9H14N2O2 Molecular Weight (g/mol): 182.223 MDL Number: MFCD00084917 InChI Key: JZPMLZWJUMATOQ-UHFFFAOYSA-N Synonym: 1-tert-butyl-3-methyl-1h-pyrazole-5-carboxylic acid,2-tert-butyl-5-methyl-pyrazole-3-carboxylic acid,1-tert-butyl-3-methylpyrazole-5-carboxylic acid,maybridge1_008627,buttpark 9218-70,2-tert-butyl-5-methyl-3-pyrazolecarboxylic acid,1-tert-butyl-5-carboxy-3-methyl-1h-pyrazole,1-tert-butyl-3-methyl-1h-pyrazole-5-carboxylic acid PubChem CID: 2744573 IUPAC Name: 2-tert-butyl-5-methylpyrazole-3-carboxylic acid SMILES: CC1=NN(C(=C1)C(=O)O)C(C)(C)C
| PubChem CID | 2744573 |
|---|---|
| CAS | 175277-09-5 |
| Molecular Weight (g/mol) | 182.223 |
| MDL Number | MFCD00084917 |
| SMILES | CC1=NN(C(=C1)C(=O)O)C(C)(C)C |
| Synonym | 1-tert-butyl-3-methyl-1h-pyrazole-5-carboxylic acid,2-tert-butyl-5-methyl-pyrazole-3-carboxylic acid,1-tert-butyl-3-methylpyrazole-5-carboxylic acid,maybridge1_008627,buttpark 9218-70,2-tert-butyl-5-methyl-3-pyrazolecarboxylic acid,1-tert-butyl-5-carboxy-3-methyl-1h-pyrazole,1-tert-butyl-3-methyl-1h-pyrazole-5-carboxylic acid |
| IUPAC Name | 2-tert-butyl-5-methylpyrazole-3-carboxylic acid |
| InChI Key | JZPMLZWJUMATOQ-UHFFFAOYSA-N |
| Molecular Formula | C9H14N2O2 |
(+)-Diisopropyl L-tartrate, 97%
CAS: 2217-15-4 Molecular Formula: C10H18O6 Molecular Weight (g/mol): 234.248 MDL Number: MFCD00064450 InChI Key: XEBCWEDRGPSHQH-HTQZYQBOSA-N Synonym: +-diisopropyl l-tartrate,2r,3r-diisopropyl 2,3-dihydroxysuccinate,di-isopropyl tartrate,diisoprropyl-l-tartrate,+-dipt,l-+-tartaric acid diisopropyl ester,diisopropyl l-tartrate,l-+-diisopropyl-tartrate, l-dipt,butanedioic acid, 2,3-dihydroxy-, bis 1-methylethyl ester, r,r-+/-,1,4-diisopropyl 2r,3r-2,3-dihydroxybutanedioate PubChem CID: 6453580 IUPAC Name: dipropan-2-yl (2R,3R)-2,3-dihydroxybutanedioate SMILES: CC(C)OC(=O)C(C(C(=O)OC(C)C)O)O
| PubChem CID | 6453580 |
|---|---|
| CAS | 2217-15-4 |
| Molecular Weight (g/mol) | 234.248 |
| MDL Number | MFCD00064450 |
| SMILES | CC(C)OC(=O)C(C(C(=O)OC(C)C)O)O |
| Synonym | +-diisopropyl l-tartrate,2r,3r-diisopropyl 2,3-dihydroxysuccinate,di-isopropyl tartrate,diisoprropyl-l-tartrate,+-dipt,l-+-tartaric acid diisopropyl ester,diisopropyl l-tartrate,l-+-diisopropyl-tartrate, l-dipt,butanedioic acid, 2,3-dihydroxy-, bis 1-methylethyl ester, r,r-+/-,1,4-diisopropyl 2r,3r-2,3-dihydroxybutanedioate |
| IUPAC Name | dipropan-2-yl (2R,3R)-2,3-dihydroxybutanedioate |
| InChI Key | XEBCWEDRGPSHQH-HTQZYQBOSA-N |
| Molecular Formula | C10H18O6 |
Zinc propionate, 97%
CAS: 557-28-8 Molecular Formula: C6H10O4Zn Molecular Weight (g/mol): 211.52 MDL Number: MFCD00045937 InChI Key: XDWXRAYGALQIFG-UHFFFAOYSA-L Synonym: zinc propionate,unii-81pxa87xvc,81pxa87xvc,propanoic acid, zinc salt 2:1,gyna-plex,propionic acid, zinc salt,zinc dipropionate,propanoic acid, zinc salt,zinc propanoate,propanoic acid, zinc salt, basic PubChem CID: 11189 IUPAC Name: zinc;propanoate SMILES: [Zn++].CCC([O-])=O.CCC([O-])=O
| PubChem CID | 11189 |
|---|---|
| CAS | 557-28-8 |
| Molecular Weight (g/mol) | 211.52 |
| MDL Number | MFCD00045937 |
| SMILES | [Zn++].CCC([O-])=O.CCC([O-])=O |
| Synonym | zinc propionate,unii-81pxa87xvc,81pxa87xvc,propanoic acid, zinc salt 2:1,gyna-plex,propionic acid, zinc salt,zinc dipropionate,propanoic acid, zinc salt,zinc propanoate,propanoic acid, zinc salt, basic |
| IUPAC Name | zinc;propanoate |
| InChI Key | XDWXRAYGALQIFG-UHFFFAOYSA-L |
| Molecular Formula | C6H10O4Zn |
Ethyl phenylcyanoacetate, 97%
CAS: 4553-07-5 Molecular Formula: C11H11NO2 Molecular Weight (g/mol): 189.21 MDL Number: MFCD00001866 InChI Key: SXIRJEDGTAKGKU-UHFFFAOYNA-N SMILES: CCOC(=O)C(C#N)C1=CC=CC=C1
| CAS | 4553-07-5 |
|---|---|
| Molecular Weight (g/mol) | 189.21 |
| MDL Number | MFCD00001866 |
| SMILES | CCOC(=O)C(C#N)C1=CC=CC=C1 |
| InChI Key | SXIRJEDGTAKGKU-UHFFFAOYNA-N |
| Molecular Formula | C11H11NO2 |
n-Hexylphosphonic acid
CAS: 4721-24-8 Molecular Formula: C6H15O3P Molecular Weight (g/mol): 166.157 MDL Number: MFCD00013961 InChI Key: GJWAEWLHSDGBGG-UHFFFAOYSA-N Synonym: n-hexylphosphonic acid,phosphonic acid, p-hexyl,hexylphosphonicacid,p-hexyl-phosphonic acid,hexylphosphonic acid PubChem CID: 312552 IUPAC Name: hexylphosphonic acid SMILES: CCCCCCP(=O)(O)O
| PubChem CID | 312552 |
|---|---|
| CAS | 4721-24-8 |
| Molecular Weight (g/mol) | 166.157 |
| MDL Number | MFCD00013961 |
| SMILES | CCCCCCP(=O)(O)O |
| Synonym | n-hexylphosphonic acid,phosphonic acid, p-hexyl,hexylphosphonicacid,p-hexyl-phosphonic acid,hexylphosphonic acid |
| IUPAC Name | hexylphosphonic acid |
| InChI Key | GJWAEWLHSDGBGG-UHFFFAOYSA-N |
| Molecular Formula | C6H15O3P |
1-Butanesulfonic acid, sodium salt, 99+%, HPLC grade
CAS: 2386-54-1 Molecular Formula: C4H9NaO3S Molecular Weight (g/mol): 160.16 MDL Number: MFCD00007540 InChI Key: XQCHMGAOAWZUPI-UHFFFAOYSA-M Synonym: sodium 1-butanesulfonate,sodium butane-1-sulfonate,1-butanesulfonic acid sodium salt,sodium butylsulfonate,1-butanesulfonic acid, sodium salt,sodium butane-1-sulphonate,sodium butanesulfonate,ipc-alks-4,1-butanesulfonic acid, sodium salt 1:1,acmc-1cdot PubChem CID: 4096517 IUPAC Name: sodium;butane-1-sulfonate SMILES: [Na+].CCCCS([O-])(=O)=O
| PubChem CID | 4096517 |
|---|---|
| CAS | 2386-54-1 |
| Molecular Weight (g/mol) | 160.16 |
| MDL Number | MFCD00007540 |
| SMILES | [Na+].CCCCS([O-])(=O)=O |
| Synonym | sodium 1-butanesulfonate,sodium butane-1-sulfonate,1-butanesulfonic acid sodium salt,sodium butylsulfonate,1-butanesulfonic acid, sodium salt,sodium butane-1-sulphonate,sodium butanesulfonate,ipc-alks-4,1-butanesulfonic acid, sodium salt 1:1,acmc-1cdot |
| IUPAC Name | sodium;butane-1-sulfonate |
| InChI Key | XQCHMGAOAWZUPI-UHFFFAOYSA-M |
| Molecular Formula | C4H9NaO3S |
2-Acrylamido-2-methylpropanesulfonic acid, 98%
CAS: 15214-89-8 Molecular Formula: C7H13NO4S Molecular Weight (g/mol): 207.24 MDL Number: MFCD00007522 InChI Key: XHZPRMZZQOIPDS-UHFFFAOYSA-N Synonym: 2-acrylamido-2-methylpropanesulfonic acid,2-acrylamido-2-methyl-1-propanesulfonic acid,2-acrylamide-2-methylpropanesulfonic acid,1-propanesulfonic acid, 2-methyl-2-1-oxo-2-propenyl amino,polyacrylamidomethylpropane sulfonic acid,unii-490hqe5ki5,2-acrylamido-2-methylpropanesulfonate,2-acrylamido-2-methylpropanesulphonic acid,2-acrylamido-2-methylpropane sulfonic acid,2-acrylamido-2-methylpropane-1-sulfonic acid PubChem CID: 65360 IUPAC Name: 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonic acid SMILES: CC(C)(CS(O)(=O)=O)NC(=O)C=C
| PubChem CID | 65360 |
|---|---|
| CAS | 15214-89-8 |
| Molecular Weight (g/mol) | 207.24 |
| MDL Number | MFCD00007522 |
| SMILES | CC(C)(CS(O)(=O)=O)NC(=O)C=C |
| Synonym | 2-acrylamido-2-methylpropanesulfonic acid,2-acrylamido-2-methyl-1-propanesulfonic acid,2-acrylamide-2-methylpropanesulfonic acid,1-propanesulfonic acid, 2-methyl-2-1-oxo-2-propenyl amino,polyacrylamidomethylpropane sulfonic acid,unii-490hqe5ki5,2-acrylamido-2-methylpropanesulfonate,2-acrylamido-2-methylpropanesulphonic acid,2-acrylamido-2-methylpropane sulfonic acid,2-acrylamido-2-methylpropane-1-sulfonic acid |
| IUPAC Name | 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonic acid |
| InChI Key | XHZPRMZZQOIPDS-UHFFFAOYSA-N |
| Molecular Formula | C7H13NO4S |
Bismuth subgallate hydrate
CAS: 342406-26-2 Molecular Formula: C7H5BiO6 Molecular Weight (g/mol): 394.09 MDL Number: MFCD00044980 InChI Key: JAONZGLTYYUPCT-UHFFFAOYSA-K Synonym: bismuth subgallate,wismutgallathydroxid,dermatol,bismuth gallate,dermatol puder,bismuth subgallas,bismutum subgallicum,basic bismuth gallate,gallic acid bismuth basic salt,wismutgallat, basisches PubChem CID: 16682999 IUPAC Name: 4-hydroxy-1,3,2$l^{2}-benzodioxabismole-6-carboxylic acid;hydrate SMILES: O[Bi]1OC2=C(O1)C(O)=CC(=C2)C(O)=O
| PubChem CID | 16682999 |
|---|---|
| CAS | 342406-26-2 |
| Molecular Weight (g/mol) | 394.09 |
| MDL Number | MFCD00044980 |
| SMILES | O[Bi]1OC2=C(O1)C(O)=CC(=C2)C(O)=O |
| Synonym | bismuth subgallate,wismutgallathydroxid,dermatol,bismuth gallate,dermatol puder,bismuth subgallas,bismutum subgallicum,basic bismuth gallate,gallic acid bismuth basic salt,wismutgallat, basisches |
| IUPAC Name | 4-hydroxy-1,3,2$l^{2}-benzodioxabismole-6-carboxylic acid;hydrate |
| InChI Key | JAONZGLTYYUPCT-UHFFFAOYSA-K |
| Molecular Formula | C7H5BiO6 |
1-Dodecylphosphonic acid, 95%
CAS: 5137-70-2 Molecular Formula: C12H27O3P Molecular Weight (g/mol): 250.32 MDL Number: MFCD00015832 InChI Key: SVMUEEINWGBIPD-UHFFFAOYSA-N Synonym: n-dodecylphosphonic acid,phosphonic acid, dodecyl,n-dodecanephosphonic acid,dodecane phosphonic acid,1-dodecanephosphonic acid,n-dodecyl phosphonic acid,dodecyl-phosphonic acid,1-dodecylphosphonic acid,phosphonic acid, p-dodecyl,n-dodecylphosphonicacid PubChem CID: 78816 IUPAC Name: dodecylphosphonic acid SMILES: CCCCCCCCCCCCP(O)(O)=O
| PubChem CID | 78816 |
|---|---|
| CAS | 5137-70-2 |
| Molecular Weight (g/mol) | 250.32 |
| MDL Number | MFCD00015832 |
| SMILES | CCCCCCCCCCCCP(O)(O)=O |
| Synonym | n-dodecylphosphonic acid,phosphonic acid, dodecyl,n-dodecanephosphonic acid,dodecane phosphonic acid,1-dodecanephosphonic acid,n-dodecyl phosphonic acid,dodecyl-phosphonic acid,1-dodecylphosphonic acid,phosphonic acid, p-dodecyl,n-dodecylphosphonicacid |
| IUPAC Name | dodecylphosphonic acid |
| InChI Key | SVMUEEINWGBIPD-UHFFFAOYSA-N |
| Molecular Formula | C12H27O3P |
Spectrum Chemical Manufacturing Corporation Peracetic Acid Solution, Approx. 32%, Spectrum™ Chemical
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CAS: 79-21-0 Molecular Formula: C2H4O2 Molecular Weight (g/mol): 60.05 MDL Number: MFCD00036152 InChI Key: QTBSBXVTEAMEQO-UHFFFAOYSA-N IUPAC Name: acetic acid SMILES: CC(O)=O
| CAS | 79-21-0 |
|---|---|
| Molecular Weight (g/mol) | 60.05 |
| MDL Number | MFCD00036152 |
| SMILES | CC(O)=O |
| IUPAC Name | acetic acid |
| InChI Key | QTBSBXVTEAMEQO-UHFFFAOYSA-N |
| Molecular Formula | C2H4O2 |
Allyl chloroacetate, 98%
CAS: 2916-14-5 Molecular Formula: C5H7ClO2 Molecular Weight (g/mol): 134.559 MDL Number: MFCD00058936 InChI Key: VMBJJCDVORDOCF-UHFFFAOYSA-N Synonym: allyl chloroacetate,allyl 2-chloroacetate,chloroacetic acid allyl ester,acetic acid, chloro-, 2-propenyl ester,prop-2-en-1-yl 2-chloroacetate,acetic acid, chloro-, allyl ester,allyl monochloroacetate,acmc-1cffa,chloroacetic acid,2-propenyl ester PubChem CID: 76206 IUPAC Name: prop-2-enyl 2-chloroacetate SMILES: C=CCOC(=O)CCl
| PubChem CID | 76206 |
|---|---|
| CAS | 2916-14-5 |
| Molecular Weight (g/mol) | 134.559 |
| MDL Number | MFCD00058936 |
| SMILES | C=CCOC(=O)CCl |
| Synonym | allyl chloroacetate,allyl 2-chloroacetate,chloroacetic acid allyl ester,acetic acid, chloro-, 2-propenyl ester,prop-2-en-1-yl 2-chloroacetate,acetic acid, chloro-, allyl ester,allyl monochloroacetate,acmc-1cffa,chloroacetic acid,2-propenyl ester |
| IUPAC Name | prop-2-enyl 2-chloroacetate |
| InChI Key | VMBJJCDVORDOCF-UHFFFAOYSA-N |
| Molecular Formula | C5H7ClO2 |
DL-Mercaptosuccinic acid, 99%
CAS: 70-49-5 Molecular Formula: C4H6O4S Molecular Weight (g/mol): 150.15 InChI Key: NJRXVEJTAYWCQJ-UHFFFAOYSA-N Synonym: mercaptosuccinic acid,thiomalic acid,2-thiomalic acid,2-mercaptosuccinic acid,monomercaptosuccinic acid,butanedioic acid, mercapto,malic acid, 2-thio,mercaptosuccinate,2-sulfanylsuccinic acid,dl-mercaptosuccinic acid PubChem CID: 6268 ChEBI: CHEBI:38705 IUPAC Name: 2-sulfanylbutanedioic acid SMILES: C(C(C(=O)O)S)C(=O)O
| PubChem CID | 6268 |
|---|---|
| CAS | 70-49-5 |
| Molecular Weight (g/mol) | 150.15 |
| ChEBI | CHEBI:38705 |
| SMILES | C(C(C(=O)O)S)C(=O)O |
| Synonym | mercaptosuccinic acid,thiomalic acid,2-thiomalic acid,2-mercaptosuccinic acid,monomercaptosuccinic acid,butanedioic acid, mercapto,malic acid, 2-thio,mercaptosuccinate,2-sulfanylsuccinic acid,dl-mercaptosuccinic acid |
| IUPAC Name | 2-sulfanylbutanedioic acid |
| InChI Key | NJRXVEJTAYWCQJ-UHFFFAOYSA-N |
| Molecular Formula | C4H6O4S |
Methyl 4-[3-(dimethylamino)propoxy]benzoate, 97%, Thermo Scientific™
CAS: 190660-97-0 Molecular Formula: C13H19NO3 Molecular Weight (g/mol): 237.30 MDL Number: MFCD06203847 InChI Key: SRXQDDFKGDLAJM-UHFFFAOYSA-N Synonym: methyl 4-3-dimethylamino propoxy benzoate,4-3-dimethylamino-propoxy-benzoic acid methyl ester,methyl 4-3-n,n-dimethylamino-1-propyloxy benzoate,methyl-4-3-n,n-dimethylamino-1-propyloxy benzoate PubChem CID: 18508114 IUPAC Name: methyl 4-[3-(dimethylamino)propoxy]benzoate SMILES: COC(=O)C1=CC=C(OCCCN(C)C)C=C1
| PubChem CID | 18508114 |
|---|---|
| CAS | 190660-97-0 |
| Molecular Weight (g/mol) | 237.30 |
| MDL Number | MFCD06203847 |
| SMILES | COC(=O)C1=CC=C(OCCCN(C)C)C=C1 |
| Synonym | methyl 4-3-dimethylamino propoxy benzoate,4-3-dimethylamino-propoxy-benzoic acid methyl ester,methyl 4-3-n,n-dimethylamino-1-propyloxy benzoate,methyl-4-3-n,n-dimethylamino-1-propyloxy benzoate |
| IUPAC Name | methyl 4-[3-(dimethylamino)propoxy]benzoate |
| InChI Key | SRXQDDFKGDLAJM-UHFFFAOYSA-N |
| Molecular Formula | C13H19NO3 |
N-Methylbenzamide, 99%
CAS: 613-93-4 Molecular Formula: C8H9NO Molecular Weight (g/mol): 135.17 MDL Number: MFCD00011642 InChI Key: NCCHARWOCKOHIH-UHFFFAOYSA-N Synonym: benzamide, n-methyl,n-methylbenzenamide,n-methyl-benzamide,n-methylbenzenecarboxamide,unii-k3ed781e08,ccris 4670,n-methyl benzamide,n-methylbenzimidic acid,acmc-1bb7i,dsstox_cid_5570 PubChem CID: 11954 IUPAC Name: N-methylbenzamide SMILES: CNC(=O)C1=CC=CC=C1
| PubChem CID | 11954 |
|---|---|
| CAS | 613-93-4 |
| Molecular Weight (g/mol) | 135.17 |
| MDL Number | MFCD00011642 |
| SMILES | CNC(=O)C1=CC=CC=C1 |
| Synonym | benzamide, n-methyl,n-methylbenzenamide,n-methyl-benzamide,n-methylbenzenecarboxamide,unii-k3ed781e08,ccris 4670,n-methyl benzamide,n-methylbenzimidic acid,acmc-1bb7i,dsstox_cid_5570 |
| IUPAC Name | N-methylbenzamide |
| InChI Key | NCCHARWOCKOHIH-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO |