Organic acids and derivatives
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DL-2-Hydroxybutyric acid sodium salt, 97+%
CAS: 5094-24-6 Molecular Formula: C4H7NaO3 Molecular Weight (g/mol): 126.09 MDL Number: MFCD00004565 InChI Key: MOSCXNXKSOHVSQ-UHFFFAOYNA-M Synonym: sodium 2-hydroxybutanoate,sodium 2-hydroxybutyrate,sodium dl-2-hydroxybutyrate,2-hydroxybutyric acid sodium salt,dl-2-hydroxybutyric acid sodium salt,sodium hydroxybutyrate,acmc-1btqj,sodium,a-hydroxybutyrate,sodium 2-oxidanylbutanoate,sodiumdl-2-hydroxybutyrate PubChem CID: 23663641 IUPAC Name: sodium;2-hydroxybutanoate SMILES: [Na+].CCC(O)C([O-])=O
| PubChem CID | 23663641 |
|---|---|
| CAS | 5094-24-6 |
| Molecular Weight (g/mol) | 126.09 |
| MDL Number | MFCD00004565 |
| SMILES | [Na+].CCC(O)C([O-])=O |
| Synonym | sodium 2-hydroxybutanoate,sodium 2-hydroxybutyrate,sodium dl-2-hydroxybutyrate,2-hydroxybutyric acid sodium salt,dl-2-hydroxybutyric acid sodium salt,sodium hydroxybutyrate,acmc-1btqj,sodium,a-hydroxybutyrate,sodium 2-oxidanylbutanoate,sodiumdl-2-hydroxybutyrate |
| IUPAC Name | sodium;2-hydroxybutanoate |
| InChI Key | MOSCXNXKSOHVSQ-UHFFFAOYNA-M |
| Molecular Formula | C4H7NaO3 |
2-Nitrobenzhydrazide, 98%
CAS: 606-26-8 Molecular Formula: C7H7N3O3 Molecular Weight (g/mol): 181.151 MDL Number: MFCD00007598 InChI Key: LYGGDXLOJMNFBV-UHFFFAOYSA-N Synonym: 2-nitrobenzhydrazide,o-nitrobenzohydrazide,o-nitrobenzhydrazide,2-nitro-benzoic acid hydrazide,2-nitrobenzoic hydrazide,benzoic acid, 2-nitro-, hydrazide,benzoylhydrazine, o-nitro,2-nitrobenzenecarbohydrazide,nitrobenzhydrazid,2-nitrobenzoylhydrazine PubChem CID: 3781218 IUPAC Name: 2-nitrobenzohydrazide SMILES: C1=CC=C(C(=C1)C(=O)NN)[N+](=O)[O-]
| PubChem CID | 3781218 |
|---|---|
| CAS | 606-26-8 |
| Molecular Weight (g/mol) | 181.151 |
| MDL Number | MFCD00007598 |
| SMILES | C1=CC=C(C(=C1)C(=O)NN)[N+](=O)[O-] |
| Synonym | 2-nitrobenzhydrazide,o-nitrobenzohydrazide,o-nitrobenzhydrazide,2-nitro-benzoic acid hydrazide,2-nitrobenzoic hydrazide,benzoic acid, 2-nitro-, hydrazide,benzoylhydrazine, o-nitro,2-nitrobenzenecarbohydrazide,nitrobenzhydrazid,2-nitrobenzoylhydrazine |
| IUPAC Name | 2-nitrobenzohydrazide |
| InChI Key | LYGGDXLOJMNFBV-UHFFFAOYSA-N |
| Molecular Formula | C7H7N3O3 |
| CAS | 5785-06-8 |
|---|---|
| MDL Number | MFCD00007601 |
Sodium dichloroacetate, 96%
CAS: 2156-56-1 Molecular Formula: C2HCl2NaO2 Molecular Weight (g/mol): 150.92 MDL Number: MFCD00070489 InChI Key: LUPNKHXLFSSUGS-UHFFFAOYSA-M Synonym: sodium dichloroacetate,sodium 2,2-dichloroacetate,dichloroacetic acid sodium salt,acetic acid, dichloro-, sodium salt,ceresine,dichloroacetate sodium,dichloroctan sodny czech,sodium dichloroacetate usan,ccris 7697,dichloroacetic acid, sodium salt PubChem CID: 517326 IUPAC Name: sodium;2,2-dichloroacetate SMILES: [Na+].[O-]C(=O)C(Cl)Cl
| PubChem CID | 517326 |
|---|---|
| CAS | 2156-56-1 |
| Molecular Weight (g/mol) | 150.92 |
| MDL Number | MFCD00070489 |
| SMILES | [Na+].[O-]C(=O)C(Cl)Cl |
| Synonym | sodium dichloroacetate,sodium 2,2-dichloroacetate,dichloroacetic acid sodium salt,acetic acid, dichloro-, sodium salt,ceresine,dichloroacetate sodium,dichloroctan sodny czech,sodium dichloroacetate usan,ccris 7697,dichloroacetic acid, sodium salt |
| IUPAC Name | sodium;2,2-dichloroacetate |
| InChI Key | LUPNKHXLFSSUGS-UHFFFAOYSA-M |
| Molecular Formula | C2HCl2NaO2 |
Triethyl 2-phosphonopropionate, 98%
CAS: 3699-66-9 Molecular Formula: C9H19O5P Molecular Weight (g/mol): 238.22 MDL Number: MFCD00009159 InChI Key: BVSRWCMAJISCTD-UHFFFAOYSA-N Synonym: triethyl 2-phosphonopropionate,ethyl 2-diethoxyphosphoryl propanoate,ethyl-2-diethylphosphono propanoate,diethyl 1-carbethoxy ethylphosphonate,propanoic acid, 2-diethoxyphosphinyl-, ethyl ester,diethyl ethoxycarbonylethyl-phosphonate,diethyl 1-ethoxycarbonyl ethanephosphonate,2-diethoxyphosphinyl propanoic acid ethyl ester,diethyl 1-ethoxycarbonyl ethanephosphonate∼2-phosphonopropionic acid triethyl ester,triethyl2-phosphonopropionate PubChem CID: 107155 IUPAC Name: ethyl 2-diethoxyphosphorylpropanoate SMILES: CCOC(=O)C(C)P(=O)(OCC)OCC
| PubChem CID | 107155 |
|---|---|
| CAS | 3699-66-9 |
| Molecular Weight (g/mol) | 238.22 |
| MDL Number | MFCD00009159 |
| SMILES | CCOC(=O)C(C)P(=O)(OCC)OCC |
| Synonym | triethyl 2-phosphonopropionate,ethyl 2-diethoxyphosphoryl propanoate,ethyl-2-diethylphosphono propanoate,diethyl 1-carbethoxy ethylphosphonate,propanoic acid, 2-diethoxyphosphinyl-, ethyl ester,diethyl ethoxycarbonylethyl-phosphonate,diethyl 1-ethoxycarbonyl ethanephosphonate,2-diethoxyphosphinyl propanoic acid ethyl ester,diethyl 1-ethoxycarbonyl ethanephosphonate∼2-phosphonopropionic acid triethyl ester,triethyl2-phosphonopropionate |
| IUPAC Name | ethyl 2-diethoxyphosphorylpropanoate |
| InChI Key | BVSRWCMAJISCTD-UHFFFAOYSA-N |
| Molecular Formula | C9H19O5P |
Sodium 1-tetradecyl sulfate, 95%, cont. up to ca 5% sodium methyl sulfate
CAS: 1191-50-0 Molecular Formula: C14H29NaO4S Molecular Weight (g/mol): 316.43 MDL Number: MFCD00007468 InChI Key: UPUIQOIQVMNQAP-UHFFFAOYSA-M Synonym: sodium tetradecyl sulfate,sodium myristyl sulfate,niaproof 4,sodium tetradecyl sulphate,tesapon k 14,texapon k 14,trombavar,natri tetradecylsulfas,sotradecol sodium,tetradecyl sodium sulfate PubChem CID: 23665770 IUPAC Name: sodium;tetradecyl sulfate SMILES: [Na+].CCCCCCCCCCCCCCOS([O-])(=O)=O
| PubChem CID | 23665770 |
|---|---|
| CAS | 1191-50-0 |
| Molecular Weight (g/mol) | 316.43 |
| MDL Number | MFCD00007468 |
| SMILES | [Na+].CCCCCCCCCCCCCCOS([O-])(=O)=O |
| Synonym | sodium tetradecyl sulfate,sodium myristyl sulfate,niaproof 4,sodium tetradecyl sulphate,tesapon k 14,texapon k 14,trombavar,natri tetradecylsulfas,sotradecol sodium,tetradecyl sodium sulfate |
| IUPAC Name | sodium;tetradecyl sulfate |
| InChI Key | UPUIQOIQVMNQAP-UHFFFAOYSA-M |
| Molecular Formula | C14H29NaO4S |
| CAS | 3891-07-4 |
|---|---|
| MDL Number | MFCD00005903 |
4-Aminoantipyrine, 97%
CAS: 83-07-8 Molecular Formula: C11H13N3O Molecular Weight (g/mol): 203.245 MDL Number: MFCD00003145 InChI Key: RLFWWDJHLFCNIJ-UHFFFAOYSA-N Synonym: 4-aminoantipyrine,ampyrone,metapirazone,aminoantipyrine,solvapyrin-a,aminoazophene,4-aminophenazone,4-aminoantipyrene,aminoantipyrin,solnapyrin-a PubChem CID: 2151 ChEBI: CHEBI:59026 IUPAC Name: 4-amino-1,5-dimethyl-2-phenylpyrazol-3-one SMILES: CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N
| PubChem CID | 2151 |
|---|---|
| CAS | 83-07-8 |
| Molecular Weight (g/mol) | 203.245 |
| ChEBI | CHEBI:59026 |
| MDL Number | MFCD00003145 |
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N |
| Synonym | 4-aminoantipyrine,ampyrone,metapirazone,aminoantipyrine,solvapyrin-a,aminoazophene,4-aminophenazone,4-aminoantipyrene,aminoantipyrin,solnapyrin-a |
| IUPAC Name | 4-amino-1,5-dimethyl-2-phenylpyrazol-3-one |
| InChI Key | RLFWWDJHLFCNIJ-UHFFFAOYSA-N |
| Molecular Formula | C11H13N3O |
3-Nitrobenzamide, 98%
CAS: 645-09-0 Molecular Formula: C7H6N2O3 Molecular Weight (g/mol): 166.136 MDL Number: MFCD00007984 InChI Key: KWAYEPXDGHYGRW-UHFFFAOYSA-N Synonym: m-nitrobenzamide,benzamide, 3-nitro,benzamide, m-nitro,3-nitro-benzamide,3-nitrophenylcarboxamide,acmc-209nmr,3-nitrobenzamide,dsstox_cid_5732,dsstox_rid_77897,dsstox_gsid_25732 PubChem CID: 12576 IUPAC Name: 3-nitrobenzamide SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N
| PubChem CID | 12576 |
|---|---|
| CAS | 645-09-0 |
| Molecular Weight (g/mol) | 166.136 |
| MDL Number | MFCD00007984 |
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N |
| Synonym | m-nitrobenzamide,benzamide, 3-nitro,benzamide, m-nitro,3-nitro-benzamide,3-nitrophenylcarboxamide,acmc-209nmr,3-nitrobenzamide,dsstox_cid_5732,dsstox_rid_77897,dsstox_gsid_25732 |
| IUPAC Name | 3-nitrobenzamide |
| InChI Key | KWAYEPXDGHYGRW-UHFFFAOYSA-N |
| Molecular Formula | C7H6N2O3 |
N-(3-Bromopropyl)phthalimide, 98%
CAS: 5460-29-7 Molecular Formula: C11H10BrNO2 Molecular Weight (g/mol): 268.11 MDL Number: MFCD00005904 InChI Key: VKJCJJYNVIYVQR-UHFFFAOYSA-N Synonym: n-3-bromopropyl phthalimide,2-3-bromopropyl isoindoline-1,3-dione,1-phthalimido-3-bromopropane,3-bromopropylphthalimide,n-3-bromopropylphthalimide,gamma-bromopropylphthalimide,2-3-bromopropyl-1h-isoindole-1,3 2h-dione,2-3-bromopropyl-2,3-dihydro-1h-isoindole-1,3-dione,phthalimide, n-3-bromopropyl,1h-isoindole-1,3 2h-dione, 2-3-bromopropyl PubChem CID: 21611 IUPAC Name: 2-(3-bromopropyl)isoindole-1,3-dione SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)CCCBr
| PubChem CID | 21611 |
|---|---|
| CAS | 5460-29-7 |
| Molecular Weight (g/mol) | 268.11 |
| MDL Number | MFCD00005904 |
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CCCBr |
| Synonym | n-3-bromopropyl phthalimide,2-3-bromopropyl isoindoline-1,3-dione,1-phthalimido-3-bromopropane,3-bromopropylphthalimide,n-3-bromopropylphthalimide,gamma-bromopropylphthalimide,2-3-bromopropyl-1h-isoindole-1,3 2h-dione,2-3-bromopropyl-2,3-dihydro-1h-isoindole-1,3-dione,phthalimide, n-3-bromopropyl,1h-isoindole-1,3 2h-dione, 2-3-bromopropyl |
| IUPAC Name | 2-(3-bromopropyl)isoindole-1,3-dione |
| InChI Key | VKJCJJYNVIYVQR-UHFFFAOYSA-N |
| Molecular Formula | C11H10BrNO2 |
1-Naphthyl acetate, 99%
CAS: 830-81-9 Molecular Formula: C12H10O2 Molecular Weight (g/mol): 186.21 MDL Number: MFCD00003922 InChI Key: VGKONPUVOVVNSU-UHFFFAOYSA-N Synonym: 1-naphthyl acetate,1-acetoxynaphthalene,alpha-naphthyl acetate,1-naphthol, acetate,a-naphthyl acetate,naphthyl acetate,naphthalene, 1-acetoxy,1-naphthalenol, acetate,acetic acid 1-naphthyl ester,alpha-naphthol acetate PubChem CID: 13247 IUPAC Name: naphthalen-1-yl acetate SMILES: CC(=O)OC1=CC=CC2=CC=CC=C21
| PubChem CID | 13247 |
|---|---|
| CAS | 830-81-9 |
| Molecular Weight (g/mol) | 186.21 |
| MDL Number | MFCD00003922 |
| SMILES | CC(=O)OC1=CC=CC2=CC=CC=C21 |
| Synonym | 1-naphthyl acetate,1-acetoxynaphthalene,alpha-naphthyl acetate,1-naphthol, acetate,a-naphthyl acetate,naphthyl acetate,naphthalene, 1-acetoxy,1-naphthalenol, acetate,acetic acid 1-naphthyl ester,alpha-naphthol acetate |
| IUPAC Name | naphthalen-1-yl acetate |
| InChI Key | VGKONPUVOVVNSU-UHFFFAOYSA-N |
| Molecular Formula | C12H10O2 |
4-Aminophthalimide, 97%
CAS: 3676-85-5 Molecular Formula: C8H6N2O2 Molecular Weight (g/mol): 162.15 MDL Number: MFCD00041854 InChI Key: PXRKCOCTEMYUEG-UHFFFAOYSA-N Synonym: 4-aminophthalimide,5-aminoisoindoline-1,3-dione,1h-isoindole-1,3 2h-dione, 5-amino,5-amino-1h-isoindole-1,3 2h-dione,5-amino-isoindole-1,3-dione,phthalimide, 4-amino,5-amino-2,3-dihydro-1h-isoindole-1,3-dione,5-amino-2h-isoindole-1,3-dione,5-amino-2h-benzo c azolidine-1,3-dione,5-aminophthalimide PubChem CID: 72915 IUPAC Name: 5-aminoisoindole-1,3-dione SMILES: NC1=CC=C2C(=O)NC(=O)C2=C1
| PubChem CID | 72915 |
|---|---|
| CAS | 3676-85-5 |
| Molecular Weight (g/mol) | 162.15 |
| MDL Number | MFCD00041854 |
| SMILES | NC1=CC=C2C(=O)NC(=O)C2=C1 |
| Synonym | 4-aminophthalimide,5-aminoisoindoline-1,3-dione,1h-isoindole-1,3 2h-dione, 5-amino,5-amino-1h-isoindole-1,3 2h-dione,5-amino-isoindole-1,3-dione,phthalimide, 4-amino,5-amino-2,3-dihydro-1h-isoindole-1,3-dione,5-amino-2h-isoindole-1,3-dione,5-amino-2h-benzo c azolidine-1,3-dione,5-aminophthalimide |
| IUPAC Name | 5-aminoisoindole-1,3-dione |
| InChI Key | PXRKCOCTEMYUEG-UHFFFAOYSA-N |
| Molecular Formula | C8H6N2O2 |
8-Octanolactam, 98%
CAS: 935-30-8 Molecular Formula: C8H15NO Molecular Weight (g/mol): 141.214 MDL Number: MFCD00003273 InChI Key: YDLSUFFXJYEVHW-UHFFFAOYSA-N Synonym: 2-azacyclononanone,caprylolactam,capryllactam,azacyclononan-2-one,8-octanelactam,8-aminooctanoic acid lactam,2-perhydroazoninone,2h-azonin-2-one, octahydro,cyclooctanone lactam,octamethylenimine, 2-oxo PubChem CID: 13632 IUPAC Name: azonan-2-one SMILES: C1CCCC(=O)NCCC1
| PubChem CID | 13632 |
|---|---|
| CAS | 935-30-8 |
| Molecular Weight (g/mol) | 141.214 |
| MDL Number | MFCD00003273 |
| SMILES | C1CCCC(=O)NCCC1 |
| Synonym | 2-azacyclononanone,caprylolactam,capryllactam,azacyclononan-2-one,8-octanelactam,8-aminooctanoic acid lactam,2-perhydroazoninone,2h-azonin-2-one, octahydro,cyclooctanone lactam,octamethylenimine, 2-oxo |
| IUPAC Name | azonan-2-one |
| InChI Key | YDLSUFFXJYEVHW-UHFFFAOYSA-N |
| Molecular Formula | C8H15NO |
meso-2,3-Dimercaptosuccinic acid, 97%
CAS: 304-55-2 Molecular Formula: C4H6O4S2 Molecular Weight (g/mol): 182.208 MDL Number: MFCD00064799 InChI Key: ACTRVOBWPAIOHC-XIXRPRMCSA-N Synonym: succimer,meso-2,3-dimercaptosuccinic acid,meso-dimercaptosuccinic acid,dmsa,dim-sa,2r,3s-rel-2,3-dimercaptosuccinic acid,succimero,succimerum,chemet,dimercaptosuccinic acid PubChem CID: 2724354 ChEBI: CHEBI:63623 IUPAC Name: (2S,3R)-2,3-bis(sulfanyl)butanedioic acid SMILES: C(C(C(=O)O)S)(C(=O)O)S
| PubChem CID | 2724354 |
|---|---|
| CAS | 304-55-2 |
| Molecular Weight (g/mol) | 182.208 |
| ChEBI | CHEBI:63623 |
| MDL Number | MFCD00064799 |
| SMILES | C(C(C(=O)O)S)(C(=O)O)S |
| Synonym | succimer,meso-2,3-dimercaptosuccinic acid,meso-dimercaptosuccinic acid,dmsa,dim-sa,2r,3s-rel-2,3-dimercaptosuccinic acid,succimero,succimerum,chemet,dimercaptosuccinic acid |
| IUPAC Name | (2S,3R)-2,3-bis(sulfanyl)butanedioic acid |
| InChI Key | ACTRVOBWPAIOHC-XIXRPRMCSA-N |
| Molecular Formula | C4H6O4S2 |
6-Chlorooxindole, 98%
CAS: 56341-37-8 Molecular Formula: C8H6ClNO Molecular Weight (g/mol): 167.592 MDL Number: MFCD00209962 InChI Key: CENVPIZOTHULGJ-UHFFFAOYSA-N Synonym: 6-chlorooxindole,6-chloroindolin-2-one,6-chloro-2-oxindole,6-chloro-2-indolinone,6-chloro-1,3-dihydro-2h-indol-2-one,6-chloro 2-oxindole,2h-indol-2-one, 6-chloro-1,3-dihydro,6-chloro-1,3-dihydro-indol-2-one,6-chloroindole-2 3h-one,6-chloro-2,3-dihydro-1h-indol-2-one PubChem CID: 736344 IUPAC Name: 6-chloro-1,3-dihydroindol-2-one SMILES: C1C2=C(C=C(C=C2)Cl)NC1=O
| PubChem CID | 736344 |
|---|---|
| CAS | 56341-37-8 |
| Molecular Weight (g/mol) | 167.592 |
| MDL Number | MFCD00209962 |
| SMILES | C1C2=C(C=C(C=C2)Cl)NC1=O |
| Synonym | 6-chlorooxindole,6-chloroindolin-2-one,6-chloro-2-oxindole,6-chloro-2-indolinone,6-chloro-1,3-dihydro-2h-indol-2-one,6-chloro 2-oxindole,2h-indol-2-one, 6-chloro-1,3-dihydro,6-chloro-1,3-dihydro-indol-2-one,6-chloroindole-2 3h-one,6-chloro-2,3-dihydro-1h-indol-2-one |
| IUPAC Name | 6-chloro-1,3-dihydroindol-2-one |
| InChI Key | CENVPIZOTHULGJ-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClNO |