Organic acids and derivatives
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Ethyl bromoacetate, 98%
CAS: 105-36-2 Molecular Formula: C4H7BrO2 Molecular Weight (g/mol): 167.002 MDL Number: MFCD00000191 InChI Key: PQJJJMRNHATNKG-UHFFFAOYSA-N Synonym: ethyl bromoacetate,antol,ethyl bromacetate,bromoacetic acid ethyl ester,ethyl monobromoacetate,acetic acid, bromo-, ethyl ester,ethoxycarbonylmethyl bromide,bromoacetic acid, ethyl ester,ethyl alpha-bromoacetate,ethyl bromo acetate PubChem CID: 7748 IUPAC Name: ethyl 2-bromoacetate SMILES: CCOC(=O)CBr
| PubChem CID | 7748 |
|---|---|
| CAS | 105-36-2 |
| Molecular Weight (g/mol) | 167.002 |
| MDL Number | MFCD00000191 |
| SMILES | CCOC(=O)CBr |
| Synonym | ethyl bromoacetate,antol,ethyl bromacetate,bromoacetic acid ethyl ester,ethyl monobromoacetate,acetic acid, bromo-, ethyl ester,ethoxycarbonylmethyl bromide,bromoacetic acid, ethyl ester,ethyl alpha-bromoacetate,ethyl bromo acetate |
| IUPAC Name | ethyl 2-bromoacetate |
| InChI Key | PQJJJMRNHATNKG-UHFFFAOYSA-N |
| Molecular Formula | C4H7BrO2 |
2-Hydroxyethyl acrylate, 97%, stab. with 200-300ppm 4-methoxyphenol
CAS: 818-61-1 Molecular Formula: C5H8O3 Molecular Weight (g/mol): 116.116 MDL Number: MFCD00002865 InChI Key: OMIGHNLMNHATMP-UHFFFAOYSA-N Synonym: 2-hydroxyethyl acrylate,hydroxyethyl acrylate,2-propenoic acid, 2-hydroxyethyl ester,ethylene glycol monoacrylate,bisomer 2hea,acrylic acid 2-hydroxyethyl ester,2-acryloyloxy ethanol,ethylene glycol, acrylate,acrylic acid, 2-hydroxyethyl ester,2-hydroxyethylacrylate PubChem CID: 13165 IUPAC Name: 2-hydroxyethyl prop-2-enoate SMILES: C=CC(=O)OCCO
| PubChem CID | 13165 |
|---|---|
| CAS | 818-61-1 |
| Molecular Weight (g/mol) | 116.116 |
| MDL Number | MFCD00002865 |
| SMILES | C=CC(=O)OCCO |
| Synonym | 2-hydroxyethyl acrylate,hydroxyethyl acrylate,2-propenoic acid, 2-hydroxyethyl ester,ethylene glycol monoacrylate,bisomer 2hea,acrylic acid 2-hydroxyethyl ester,2-acryloyloxy ethanol,ethylene glycol, acrylate,acrylic acid, 2-hydroxyethyl ester,2-hydroxyethylacrylate |
| IUPAC Name | 2-hydroxyethyl prop-2-enoate |
| InChI Key | OMIGHNLMNHATMP-UHFFFAOYSA-N |
| Molecular Formula | C5H8O3 |
4-Nitrophenyl phosphate, 97%
CAS: 330-13-2 Molecular Formula: C6H6NO6P Molecular Weight (g/mol): 219.09 InChI Key: XZKIHKMTEMTJQX-UHFFFAOYSA-N Synonym: 4-nitrophenyl phosphate,4-nitrophenyl dihydrogen phosphate,nitrophenylphosphate,phosphoric acid, mono 4-nitrophenyl ester,p-nitrophenyl phosphate,p-nitrophenyl dihydrogen phosphate,p-nitrophenol phosphate,p-nitrophenylphosphate,pnpp PubChem CID: 378 ChEBI: CHEBI:17440 SMILES: C1=CC(=CC=C1[N+](=O)[O-])OP(=O)(O)O
| PubChem CID | 378 |
|---|---|
| CAS | 330-13-2 |
| Molecular Weight (g/mol) | 219.09 |
| ChEBI | CHEBI:17440 |
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])OP(=O)(O)O |
| Synonym | 4-nitrophenyl phosphate,4-nitrophenyl dihydrogen phosphate,nitrophenylphosphate,phosphoric acid, mono 4-nitrophenyl ester,p-nitrophenyl phosphate,p-nitrophenyl dihydrogen phosphate,p-nitrophenol phosphate,p-nitrophenylphosphate,pnpp |
| InChI Key | XZKIHKMTEMTJQX-UHFFFAOYSA-N |
| Molecular Formula | C6H6NO6P |
Methyl formate, 97%, may cont. up to ca 3% methanol
CAS: 107-31-3 Molecular Formula: C2H4O2 Molecular Weight (g/mol): 60.05 MDL Number: MFCD00003291 InChI Key: TZIHFWKZFHZASV-UHFFFAOYSA-N Synonym: formic acid, methyl ester,methyl methanoate,methylformiat,formic acid methyl ester,formiate de methyle,methylformiaat,mravencan methylnaty,methylformate,caswell no. 570,hcooch3 PubChem CID: 7865 ChEBI: CHEBI:77699 IUPAC Name: methyl formate SMILES: COC=O
| PubChem CID | 7865 |
|---|---|
| CAS | 107-31-3 |
| Molecular Weight (g/mol) | 60.05 |
| ChEBI | CHEBI:77699 |
| MDL Number | MFCD00003291 |
| SMILES | COC=O |
| Synonym | formic acid, methyl ester,methyl methanoate,methylformiat,formic acid methyl ester,formiate de methyle,methylformiaat,mravencan methylnaty,methylformate,caswell no. 570,hcooch3 |
| IUPAC Name | methyl formate |
| InChI Key | TZIHFWKZFHZASV-UHFFFAOYSA-N |
| Molecular Formula | C2H4O2 |
Propionamide, 97%
CAS: 79-05-0 Molecular Formula: C3H7NO Molecular Weight (g/mol): 73.09 MDL Number: MFCD00008039 InChI Key: QLNJFJADRCOGBJ-UHFFFAOYSA-N Synonym: propionamide,propylamide,propionic amide,propionimidic acid,propanimidic acid,propionic acid amide,amid kyseliny propionove,propanimidic acid van,propionimidic acid van,unii-qk07g0hp47 PubChem CID: 6578 ChEBI: CHEBI:45422 IUPAC Name: propanamide SMILES: CCC(=O)N
| PubChem CID | 6578 |
|---|---|
| CAS | 79-05-0 |
| Molecular Weight (g/mol) | 73.09 |
| ChEBI | CHEBI:45422 |
| MDL Number | MFCD00008039 |
| SMILES | CCC(=O)N |
| Synonym | propionamide,propylamide,propionic amide,propionimidic acid,propanimidic acid,propionic acid amide,amid kyseliny propionove,propanimidic acid van,propionimidic acid van,unii-qk07g0hp47 |
| IUPAC Name | propanamide |
| InChI Key | QLNJFJADRCOGBJ-UHFFFAOYSA-N |
| Molecular Formula | C3H7NO |
L-Ascorbic acid, ≥99%, MP Biomedicals™
CAS: 134-03-2 Molecular Formula: C6H7NaO6 Molecular Weight (g/mol): 198.11 InChI Key: IFVCRSPJFHGFCG-HXPAKLQESA-N Synonym: sodium ascorbate,l-ascorbic acid sodium salt,sodium l-ascorbate,vitamin c sodium,ascorbicin,sodascorbate,cebitate,aminofenitrooxon,natrii ascorbas,monosodium l-ascorbate PubChem CID: 131674100 IUPAC Name: sodium 5-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-2,4-dioxooxolan-3-ide SMILES: [Na+].OC[C@H](O)C1OC(=O)[C-](O)C1=O
| PubChem CID | 131674100 |
|---|---|
| CAS | 134-03-2 |
| Molecular Weight (g/mol) | 198.11 |
| SMILES | [Na+].OC[C@H](O)C1OC(=O)[C-](O)C1=O |
| Synonym | sodium ascorbate,l-ascorbic acid sodium salt,sodium l-ascorbate,vitamin c sodium,ascorbicin,sodascorbate,cebitate,aminofenitrooxon,natrii ascorbas,monosodium l-ascorbate |
| IUPAC Name | sodium 5-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-2,4-dioxooxolan-3-ide |
| InChI Key | IFVCRSPJFHGFCG-HXPAKLQESA-N |
| Molecular Formula | C6H7NaO6 |
1-Heptanesulfonic Acid, Sodium Salt, Monohydrate, HPLC Grade, 99% min., MilliporeSigma™
CAS: 22767-50-6 Molecular Formula: C7H15NaO3S InChI Key: REFMEZARFCPESH-UHFFFAOYSA-M
| CAS | 22767-50-6 |
|---|---|
| InChI Key | REFMEZARFCPESH-UHFFFAOYSA-M |
| Molecular Formula | C7H15NaO3S |
Aminoguanidine hydrogen carbonate, 98+%
CAS: 2582-30-1 Molecular Formula: C2H8N4O3 Molecular Weight (g/mol): 136.111 MDL Number: MFCD00012949 InChI Key: OTXHZHQQWQTQMW-UHFFFAOYSA-N Synonym: aminoguanidine bicarbonate,aminoguanidine hydrogen carbonate,aminoguanidinium bicarbonate,aminoguanidine hydrocarbonate,aminoguanidine carbonate 1:1,aminoguanidium hydrogen carbonate,n1-aminoguanidine carbonate 1:1,aminoguanidine hydrogencarbonate,aminoguanidinebicarbonate,hydrazinecarboximidamide carbonate PubChem CID: 164944 IUPAC Name: 2-aminoguanidine;carbonic acid SMILES: C(=NN)(N)N.C(=O)(O)O
| PubChem CID | 164944 |
|---|---|
| CAS | 2582-30-1 |
| Molecular Weight (g/mol) | 136.111 |
| MDL Number | MFCD00012949 |
| SMILES | C(=NN)(N)N.C(=O)(O)O |
| Synonym | aminoguanidine bicarbonate,aminoguanidine hydrogen carbonate,aminoguanidinium bicarbonate,aminoguanidine hydrocarbonate,aminoguanidine carbonate 1:1,aminoguanidium hydrogen carbonate,n1-aminoguanidine carbonate 1:1,aminoguanidine hydrogencarbonate,aminoguanidinebicarbonate,hydrazinecarboximidamide carbonate |
| IUPAC Name | 2-aminoguanidine;carbonic acid |
| InChI Key | OTXHZHQQWQTQMW-UHFFFAOYSA-N |
| Molecular Formula | C2H8N4O3 |
Spectrum Chemical Manufacturing Corporation Sodium Gluconate, FCC, 98-102%, Spectrum™ Chemical
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CAS: 527-07-1 Molecular Formula: C6H11NaO7 Molecular Weight (g/mol): 218.14 InChI Key: UPMFZISCCZSDND-UHFFFAOYNA-M IUPAC Name: sodium 2,3,4,5,6-pentahydroxyhexanoate SMILES: [Na+].OCC(O)C(O)C(O)C(O)C([O-])=O
| CAS | 527-07-1 |
|---|---|
| Molecular Weight (g/mol) | 218.14 |
| SMILES | [Na+].OCC(O)C(O)C(O)C(O)C([O-])=O |
| IUPAC Name | sodium 2,3,4,5,6-pentahydroxyhexanoate |
| InChI Key | UPMFZISCCZSDND-UHFFFAOYNA-M |
| Molecular Formula | C6H11NaO7 |
BAPTA tetraethyl ester, 98+%
CAS: 73630-07-6 Molecular Formula: C30H40N2O10 Molecular Weight (g/mol): 588.654 MDL Number: MFCD00532663 InChI Key: OLXCPQDFHUCXBA-UHFFFAOYSA-N Synonym: bapta tetraethyl ester,tetraethyl 2,2',2,2'-ethane-1,2-diylbis oxy bis 2,1-phenylene bis azanetriyl tetraacetate,1,2-bis 2-aminophenoxy ethane-n,n,n',n'-tetraacetic acid tetraethyl ester,tetraethyl 2,2',2,2'-ethane-1,2-diylbis oxy-2,1-phenylenenitrilo tetraacetate,2-2-2-2-bis 2-ethoxy-2-oxoethyl amino phenoxy ethoxy-n-2-ethoxy-2-oxoethyl anilino acetic acid ethyl ester,ethyl 2-2-2-2-bis 2-ethoxy-2-oxidanylidene-ethyl amino phenoxy ethoxy phenyl-2-ethoxy-2-oxidanylidene-ethyl amino ethanoate,ethyl 2-2-2-2-bis 2-ethoxy-2-oxoethyl amino phenoxy ethoxy-n-2-ethoxy-2-oxoethyl anilino acetate,ethyl 2-2-2-2-bis 2-ethoxy-2-oxoethyl amino phenoxy ethoxy phenyl 2-ethoxy-2-oxoethyl amino acetate PubChem CID: 339960 IUPAC Name: ethyl 2-[2-[2-[2-[bis(2-ethoxy-2-oxoethyl)amino]phenoxy]ethoxy]-N-(2-ethoxy-2-oxoethyl)anilino]acetate SMILES: CCOC(=O)CN(CC(=O)OCC)C1=CC=CC=C1OCCOC2=CC=CC=C2N(CC(=O)OCC)CC(=O)OCC
| PubChem CID | 339960 |
|---|---|
| CAS | 73630-07-6 |
| Molecular Weight (g/mol) | 588.654 |
| MDL Number | MFCD00532663 |
| SMILES | CCOC(=O)CN(CC(=O)OCC)C1=CC=CC=C1OCCOC2=CC=CC=C2N(CC(=O)OCC)CC(=O)OCC |
| Synonym | bapta tetraethyl ester,tetraethyl 2,2',2,2'-ethane-1,2-diylbis oxy bis 2,1-phenylene bis azanetriyl tetraacetate,1,2-bis 2-aminophenoxy ethane-n,n,n',n'-tetraacetic acid tetraethyl ester,tetraethyl 2,2',2,2'-ethane-1,2-diylbis oxy-2,1-phenylenenitrilo tetraacetate,2-2-2-2-bis 2-ethoxy-2-oxoethyl amino phenoxy ethoxy-n-2-ethoxy-2-oxoethyl anilino acetic acid ethyl ester,ethyl 2-2-2-2-bis 2-ethoxy-2-oxidanylidene-ethyl amino phenoxy ethoxy phenyl-2-ethoxy-2-oxidanylidene-ethyl amino ethanoate,ethyl 2-2-2-2-bis 2-ethoxy-2-oxoethyl amino phenoxy ethoxy-n-2-ethoxy-2-oxoethyl anilino acetate,ethyl 2-2-2-2-bis 2-ethoxy-2-oxoethyl amino phenoxy ethoxy phenyl 2-ethoxy-2-oxoethyl amino acetate |
| IUPAC Name | ethyl 2-[2-[2-[2-[bis(2-ethoxy-2-oxoethyl)amino]phenoxy]ethoxy]-N-(2-ethoxy-2-oxoethyl)anilino]acetate |
| InChI Key | OLXCPQDFHUCXBA-UHFFFAOYSA-N |
| Molecular Formula | C30H40N2O10 |
Hydroxyurea, 98%
CAS: 127-07-1 Molecular Formula: CH4N2O2 Molecular Weight (g/mol): 76.04 MDL Number: MFCD00007943 InChI Key: VSNHCAURESNICA-UHFFFAOYSA-N Synonym: hydroxycarbamide,n-hydroxyurea,hydrea,1-hydroxyurea,oxyurea,carbamoyl oxime,biosupressin,hydroxycarbamine,onco-carbide,carbamohydroxamic acid PubChem CID: 3657 ChEBI: CHEBI:44423 IUPAC Name: hydroxyurea SMILES: C(=O)(N)NO
| PubChem CID | 3657 |
|---|---|
| CAS | 127-07-1 |
| Molecular Weight (g/mol) | 76.04 |
| ChEBI | CHEBI:44423 |
| MDL Number | MFCD00007943 |
| SMILES | C(=O)(N)NO |
| Synonym | hydroxycarbamide,n-hydroxyurea,hydrea,1-hydroxyurea,oxyurea,carbamoyl oxime,biosupressin,hydroxycarbamine,onco-carbide,carbamohydroxamic acid |
| IUPAC Name | hydroxyurea |
| InChI Key | VSNHCAURESNICA-UHFFFAOYSA-N |
| Molecular Formula | CH4N2O2 |
Diethyl difluoromalonate, 97%
CAS: 680-65-9 Molecular Formula: C7H10F2O4 Molecular Weight (g/mol): 196.15 MDL Number: MFCD00221617 InChI Key: WCRVWLHTROHXBB-UHFFFAOYSA-N Synonym: diethyl 2,2-difluoromalonate,diethyl difluoromalonate,2,2-difluoro-malonic acid diethyl ester,1,3-diethyl 2,2-difluoropropanedioate,difluoromalonic acid diethyl ester,diethyl2,2-difluoromalonate,propanedioic acid, 2,2-difluoro-, 1,3-diethyl ester,propanedioic acid, difluoro-, diethyl ester,diethyl 2,2-difluoromalonate #,diethyl2,2-difluoropropanedioatev PubChem CID: 260648 IUPAC Name: diethyl 2,2-difluoropropanedioate SMILES: CCOC(=O)C(F)(F)C(=O)OCC
| PubChem CID | 260648 |
|---|---|
| CAS | 680-65-9 |
| Molecular Weight (g/mol) | 196.15 |
| MDL Number | MFCD00221617 |
| SMILES | CCOC(=O)C(F)(F)C(=O)OCC |
| Synonym | diethyl 2,2-difluoromalonate,diethyl difluoromalonate,2,2-difluoro-malonic acid diethyl ester,1,3-diethyl 2,2-difluoropropanedioate,difluoromalonic acid diethyl ester,diethyl2,2-difluoromalonate,propanedioic acid, 2,2-difluoro-, 1,3-diethyl ester,propanedioic acid, difluoro-, diethyl ester,diethyl 2,2-difluoromalonate #,diethyl2,2-difluoropropanedioatev |
| IUPAC Name | diethyl 2,2-difluoropropanedioate |
| InChI Key | WCRVWLHTROHXBB-UHFFFAOYSA-N |
| Molecular Formula | C7H10F2O4 |
Thermo Scientific Chemicals beta-D-Ribofuranose 1,2,3,5-tetraacetate, 98+%
CAS: 13035-61-5 Molecular Formula: C13H18O9 Molecular Weight (g/mol): 318.27 MDL Number: MFCD00005358 InChI Key: IHNHAHWGVLXCCI-FDYHWXHSSA-N Synonym: beta-d-ribofuranose 1,2,3,5-tetraacetate,tetra-o-acetyl-beta-d-ribofuranose,1,2,3,5-tetra-o-acetyl-beta-d-ribofuranose,tetraacetylribose,1,2,3,5-tetraacetyl-.-d-ribofuranose,tetra-o-acetyl-b-d-ribofuranose,1,2,3,5-tetraacetyl-beta-d-ribofuranose,1,2,3,5-tetra-o-acetyl-b-d-ribofuranose,.beta.-d-ribofuranose, tetraacetate,ribofuranose, tetraacetate, .beta.-d PubChem CID: 83064 IUPAC Name: [(2R,3R,4R,5S)-3,4,5-triacetyloxyoxolan-2-yl]methyl acetate SMILES: CC(=O)OCC1C(C(C(O1)OC(=O)C)OC(=O)C)OC(=O)C
| PubChem CID | 83064 |
|---|---|
| CAS | 13035-61-5 |
| Molecular Weight (g/mol) | 318.27 |
| MDL Number | MFCD00005358 |
| SMILES | CC(=O)OCC1C(C(C(O1)OC(=O)C)OC(=O)C)OC(=O)C |
| Synonym | beta-d-ribofuranose 1,2,3,5-tetraacetate,tetra-o-acetyl-beta-d-ribofuranose,1,2,3,5-tetra-o-acetyl-beta-d-ribofuranose,tetraacetylribose,1,2,3,5-tetraacetyl-.-d-ribofuranose,tetra-o-acetyl-b-d-ribofuranose,1,2,3,5-tetraacetyl-beta-d-ribofuranose,1,2,3,5-tetra-o-acetyl-b-d-ribofuranose,.beta.-d-ribofuranose, tetraacetate,ribofuranose, tetraacetate, .beta.-d |
| IUPAC Name | [(2R,3R,4R,5S)-3,4,5-triacetyloxyoxolan-2-yl]methyl acetate |
| InChI Key | IHNHAHWGVLXCCI-FDYHWXHSSA-N |
| Molecular Formula | C13H18O9 |
1-Naphthaleneacetic Acid, 97%, Spectrum™ Chemical
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CAS: 86-87-3 Molecular Formula: C12H10O2 Molecular Weight (g/mol): 186.21 MDL Number: MFCD00004046 InChI Key: PRPINYUDVPFIRX-UHFFFAOYSA-N IUPAC Name: 2-(naphthalen-1-yl)acetic acid SMILES: OC(=O)CC1=C2C=CC=CC2=CC=C1
| CAS | 86-87-3 |
|---|---|
| Molecular Weight (g/mol) | 186.21 |
| MDL Number | MFCD00004046 |
| SMILES | OC(=O)CC1=C2C=CC=CC2=CC=C1 |
| IUPAC Name | 2-(naphthalen-1-yl)acetic acid |
| InChI Key | PRPINYUDVPFIRX-UHFFFAOYSA-N |
| Molecular Formula | C12H10O2 |
Methyl (S)-(+)-3-hydroxybutyrate, 99%, Thermo Scientific™
CAS: 53562-86-0 Molecular Formula: C5H10O3 Molecular Weight (g/mol): 118.13 MDL Number: MFCD00064461 InChI Key: LDLDJEAVRNAEBW-UHFFFAOYNA-N Synonym: methyl s-+-3-hydroxybutyrate,s-methyl 3-hydroxybutanoate,methyl s-3-hydroxybutyrate,s-3-hydroxybutanoic acid methyl ester,unii-g10281a5ah,methyl 3s-3-hydroxybutanoate,butanoic acid, 3-hydroxy-, methyl ester, 3s,methyl-s-3-hydroxybutyrate,s-+-3-hydroxy-n-butyric acid methyl ester,s-3-hydroxybutyric acid methyl ester PubChem CID: 6950307 IUPAC Name: methyl (3S)-3-hydroxybutanoate SMILES: COC(=O)CC(C)O
| PubChem CID | 6950307 |
|---|---|
| CAS | 53562-86-0 |
| Molecular Weight (g/mol) | 118.13 |
| MDL Number | MFCD00064461 |
| SMILES | COC(=O)CC(C)O |
| Synonym | methyl s-+-3-hydroxybutyrate,s-methyl 3-hydroxybutanoate,methyl s-3-hydroxybutyrate,s-3-hydroxybutanoic acid methyl ester,unii-g10281a5ah,methyl 3s-3-hydroxybutanoate,butanoic acid, 3-hydroxy-, methyl ester, 3s,methyl-s-3-hydroxybutyrate,s-+-3-hydroxy-n-butyric acid methyl ester,s-3-hydroxybutyric acid methyl ester |
| IUPAC Name | methyl (3S)-3-hydroxybutanoate |
| InChI Key | LDLDJEAVRNAEBW-UHFFFAOYNA-N |
| Molecular Formula | C5H10O3 |