Organic acids and derivatives
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Methyl 2-methoxypropionate, 98%
CAS: 17639-76-8 Molecular Formula: C5H10O3 Molecular Weight (g/mol): 118.132 MDL Number: MFCD00151664 InChI Key: VABBJJOSOCPYIT-UHFFFAOYSA-N Synonym: methyl 2-methoxypropionate,propanoic acid, 2-methoxy-, methyl ester,acmc-20akie,d +-alpha-methoxy-propionic acid methyl ester,methyl2-methoxypropanoate,methyl 2-methoxy-propionate,2-methoxypropanoic acid methyl ester,racemic 2-methoxy-propionic acid methyl ester PubChem CID: 86599 IUPAC Name: methyl 2-methoxypropanoate SMILES: CC(C(=O)OC)OC
| PubChem CID | 86599 |
|---|---|
| CAS | 17639-76-8 |
| Molecular Weight (g/mol) | 118.132 |
| MDL Number | MFCD00151664 |
| SMILES | CC(C(=O)OC)OC |
| Synonym | methyl 2-methoxypropionate,propanoic acid, 2-methoxy-, methyl ester,acmc-20akie,d +-alpha-methoxy-propionic acid methyl ester,methyl2-methoxypropanoate,methyl 2-methoxy-propionate,2-methoxypropanoic acid methyl ester,racemic 2-methoxy-propionic acid methyl ester |
| IUPAC Name | methyl 2-methoxypropanoate |
| InChI Key | VABBJJOSOCPYIT-UHFFFAOYSA-N |
| Molecular Formula | C5H10O3 |
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 |
2-Nitrobenzamide, 98%
CAS: 610-15-1 Molecular Formula: C7H6N2O3 Molecular Weight (g/mol): 166.136 MDL Number: MFCD00007976 InChI Key: KLGQWSOYKYFBTR-UHFFFAOYSA-N Synonym: o-nitrobenzamide,benzamide, o-nitro,benzamide, 2-nitro,2-carbamoylnitrobenzene,nitrobenzamide,nitro-benzamide,2-nitro-benzamide,benzamide,2-nitro,benzmide, 2-nitro,wln: zvr bnw PubChem CID: 11876 IUPAC Name: 2-nitrobenzamide SMILES: C1=CC=C(C(=C1)C(=O)N)[N+](=O)[O-]
| PubChem CID | 11876 |
|---|---|
| CAS | 610-15-1 |
| Molecular Weight (g/mol) | 166.136 |
| MDL Number | MFCD00007976 |
| SMILES | C1=CC=C(C(=C1)C(=O)N)[N+](=O)[O-] |
| Synonym | o-nitrobenzamide,benzamide, o-nitro,benzamide, 2-nitro,2-carbamoylnitrobenzene,nitrobenzamide,nitro-benzamide,2-nitro-benzamide,benzamide,2-nitro,benzmide, 2-nitro,wln: zvr bnw |
| IUPAC Name | 2-nitrobenzamide |
| InChI Key | KLGQWSOYKYFBTR-UHFFFAOYSA-N |
| Molecular Formula | C7H6N2O3 |
4-Hydroxybenzoic acid, sodium salt, 98%
CAS: 114-63-6 Molecular Formula: C7H5NaO3 Molecular Weight (g/mol): 160.10 MDL Number: MFCD00016530 InChI Key: ZLVSYODPTJZFMK-UHFFFAOYSA-M Synonym: sodium 4-hydroxybenzoate,sodium p-hydroxybenzoate,4-hydroxybenzoic acid sodium salt,sodium paraben,benzoic acid, 4-hydroxy-, monosodium salt,p-hydroxybenzoic acid sodium salt,monosodium p-hydroxybenzoate,monosodium 4-hydroxybenzoate,benzoic acid, p-hydroxy-, sodium salt,benzoic acid, 4-hydroxy-, sodium salt 1:1 PubChem CID: 16219477 IUPAC Name: sodium;4-hydroxybenzoate SMILES: [Na+].OC1=CC=C(C=C1)C([O-])=O
| PubChem CID | 16219477 |
|---|---|
| CAS | 114-63-6 |
| Molecular Weight (g/mol) | 160.10 |
| MDL Number | MFCD00016530 |
| SMILES | [Na+].OC1=CC=C(C=C1)C([O-])=O |
| Synonym | sodium 4-hydroxybenzoate,sodium p-hydroxybenzoate,4-hydroxybenzoic acid sodium salt,sodium paraben,benzoic acid, 4-hydroxy-, monosodium salt,p-hydroxybenzoic acid sodium salt,monosodium p-hydroxybenzoate,monosodium 4-hydroxybenzoate,benzoic acid, p-hydroxy-, sodium salt,benzoic acid, 4-hydroxy-, sodium salt 1:1 |
| IUPAC Name | sodium;4-hydroxybenzoate |
| InChI Key | ZLVSYODPTJZFMK-UHFFFAOYSA-M |
| Molecular Formula | C7H5NaO3 |
3-Pyridinesulfonic acid, 98%
CAS: 636-73-7 Molecular Formula: C5H4NO3S Molecular Weight (g/mol): 158.15 MDL Number: MFCD00006381 InChI Key: DVECLMOWYVDJRM-UHFFFAOYSA-M Synonym: 3-pyridinesulfonic acid,pyridine-3-sulphonic acid,3-pyridylsulfonic acid,3-pyridine sulfonic acid,3-sulfopyridine,beta-sulfopyridine,3-pyridinesulfonicacid,pubchem9608,pyridin-3-sulfonic acid,acmc-209nh7 PubChem CID: 69468 IUPAC Name: pyridine-3-sulfonic acid SMILES: [O-]S(=O)(=O)C1=CC=CN=C1
| PubChem CID | 69468 |
|---|---|
| CAS | 636-73-7 |
| Molecular Weight (g/mol) | 158.15 |
| MDL Number | MFCD00006381 |
| SMILES | [O-]S(=O)(=O)C1=CC=CN=C1 |
| Synonym | 3-pyridinesulfonic acid,pyridine-3-sulphonic acid,3-pyridylsulfonic acid,3-pyridine sulfonic acid,3-sulfopyridine,beta-sulfopyridine,3-pyridinesulfonicacid,pubchem9608,pyridin-3-sulfonic acid,acmc-209nh7 |
| IUPAC Name | pyridine-3-sulfonic acid |
| InChI Key | DVECLMOWYVDJRM-UHFFFAOYSA-M |
| Molecular Formula | C5H4NO3S |
n-Tributyl Phosphate, 96.5%, Spectrum™ Chemical
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CAS: 126-73-8
| CAS | 126-73-8 |
|---|
Acetic hydrazide, 96%
CAS: 1068-57-1 Molecular Formula: C2H6N2O Molecular Weight (g/mol): 74.083 MDL Number: MFCD00007610 InChI Key: OFLXLNCGODUUOT-UHFFFAOYSA-N Synonym: acethydrazide,acetylhydrazine,acetic hydrazide,acetic acid hydrazide,acetyl hydrazide,monoacetylhydrazine,n-acetylhydrazine,ethanehydrazonic acid,acetic acid, hydrazide,acetyl hydrazine PubChem CID: 14039 ChEBI: CHEBI:48978 IUPAC Name: acetohydrazide SMILES: CC(=O)NN
| PubChem CID | 14039 |
|---|---|
| CAS | 1068-57-1 |
| Molecular Weight (g/mol) | 74.083 |
| ChEBI | CHEBI:48978 |
| MDL Number | MFCD00007610 |
| SMILES | CC(=O)NN |
| Synonym | acethydrazide,acetylhydrazine,acetic hydrazide,acetic acid hydrazide,acetyl hydrazide,monoacetylhydrazine,n-acetylhydrazine,ethanehydrazonic acid,acetic acid, hydrazide,acetyl hydrazine |
| IUPAC Name | acetohydrazide |
| InChI Key | OFLXLNCGODUUOT-UHFFFAOYSA-N |
| Molecular Formula | C2H6N2O |
Methyl isobutyrate, 98%
CAS: 547-63-7 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.133 MDL Number: MFCD00008914 InChI Key: BHIWKHZACMWKOJ-UHFFFAOYSA-N Synonym: methyl isobutyrate,methyl 2-methylpropionate,methyl isobutanoate,propanoic acid, 2-methyl-, methyl ester,isobutyric acid, methyl ester,methylisobutyrate,isobutyric acid methyl ester,poly d-lactide,methyl isobutyrate natural,methylester kyseliny isomaselne PubChem CID: 11039 ChEBI: CHEBI:73689 IUPAC Name: methyl 2-methylpropanoate SMILES: CC(C)C(=O)OC
| PubChem CID | 11039 |
|---|---|
| CAS | 547-63-7 |
| Molecular Weight (g/mol) | 102.133 |
| ChEBI | CHEBI:73689 |
| MDL Number | MFCD00008914 |
| SMILES | CC(C)C(=O)OC |
| Synonym | methyl isobutyrate,methyl 2-methylpropionate,methyl isobutanoate,propanoic acid, 2-methyl-, methyl ester,isobutyric acid, methyl ester,methylisobutyrate,isobutyric acid methyl ester,poly d-lactide,methyl isobutyrate natural,methylester kyseliny isomaselne |
| IUPAC Name | methyl 2-methylpropanoate |
| InChI Key | BHIWKHZACMWKOJ-UHFFFAOYSA-N |
| Molecular Formula | C5H10O2 |
Phenylpropiolic acid, 98+%
CAS: 637-44-5 Molecular Formula: C9H6O2 Molecular Weight (g/mol): 146.15 MDL Number: MFCD00004361 InChI Key: XNERWVPQCYSMLC-UHFFFAOYSA-N Synonym: phenylpropiolic acid,3-phenylpropiolic acid,phenylpropynoic acid,3-phenylpropynoic acid,2-propynoic acid, 3-phenyl,phenylacetylenecarboxylic acid,3-phenyl-2-propynoic acid,phenylacetylene monocarboxylic acid,propiolic acid, 3-phenyl,phenyl propiolic acid PubChem CID: 69475 IUPAC Name: 3-phenylprop-2-ynoic acid SMILES: OC(=O)C#CC1=CC=CC=C1
| PubChem CID | 69475 |
|---|---|
| CAS | 637-44-5 |
| Molecular Weight (g/mol) | 146.15 |
| MDL Number | MFCD00004361 |
| SMILES | OC(=O)C#CC1=CC=CC=C1 |
| Synonym | phenylpropiolic acid,3-phenylpropiolic acid,phenylpropynoic acid,3-phenylpropynoic acid,2-propynoic acid, 3-phenyl,phenylacetylenecarboxylic acid,3-phenyl-2-propynoic acid,phenylacetylene monocarboxylic acid,propiolic acid, 3-phenyl,phenyl propiolic acid |
| IUPAC Name | 3-phenylprop-2-ynoic acid |
| InChI Key | XNERWVPQCYSMLC-UHFFFAOYSA-N |
| Molecular Formula | C9H6O2 |
Formaldehyde sodium bisulfite, 95%
CAS: 870-72-4 Molecular Formula: CH3NaO4S Molecular Weight (g/mol): 134.081 MDL Number: MFCD00044664 InChI Key: UOULCEYHQNCFFH-UHFFFAOYSA-M Synonym: sodium hydroxymethanesulfonate,formaldehyde sodium bisulfite,formbis,sodium formaldehyde bisulfite,sodium hydroxymethanesulphonate,methanesulfonic acid, hydroxy-, monosodium salt,sodium hydroxymethane sulfonate,sodium formaldehydebisulfite,unii-i566kha05f,methylolsulfonic acid sodium salt PubChem CID: 2723822 IUPAC Name: sodium;hydroxymethanesulfonate SMILES: C(O)S(=O)(=O)[O-].[Na+]
| PubChem CID | 2723822 |
|---|---|
| CAS | 870-72-4 |
| Molecular Weight (g/mol) | 134.081 |
| MDL Number | MFCD00044664 |
| SMILES | C(O)S(=O)(=O)[O-].[Na+] |
| Synonym | sodium hydroxymethanesulfonate,formaldehyde sodium bisulfite,formbis,sodium formaldehyde bisulfite,sodium hydroxymethanesulphonate,methanesulfonic acid, hydroxy-, monosodium salt,sodium hydroxymethane sulfonate,sodium formaldehydebisulfite,unii-i566kha05f,methylolsulfonic acid sodium salt |
| IUPAC Name | sodium;hydroxymethanesulfonate |
| InChI Key | UOULCEYHQNCFFH-UHFFFAOYSA-M |
| Molecular Formula | CH3NaO4S |
Magnesium trifluoromethanesulfonate, 97%
CAS: 60871-83-2 Molecular Formula: C2F6MgO6S2 Molecular Weight (g/mol): 322.431 MDL Number: MFCD00042601 InChI Key: BZQRBEVTLZHKEA-UHFFFAOYSA-L Synonym: magnesium trifluoromethanesulfonate,magnesium triflate,magnesium 2+ ditriflate,trifluoromethanesulfonic acid magnesium salt,magnesium trifluoromethanesulphonate,methanesulfonic acid, trifluoro-, magnesium salt,magnesiumtrifluoromethanesulfonate,magnesium trifiate,acmc-209mmv,ksc352a4p PubChem CID: 2734125 IUPAC Name: magnesium;trifluoromethanesulfonate SMILES: C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Mg+2]
| PubChem CID | 2734125 |
|---|---|
| CAS | 60871-83-2 |
| Molecular Weight (g/mol) | 322.431 |
| MDL Number | MFCD00042601 |
| SMILES | C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Mg+2] |
| Synonym | magnesium trifluoromethanesulfonate,magnesium triflate,magnesium 2+ ditriflate,trifluoromethanesulfonic acid magnesium salt,magnesium trifluoromethanesulphonate,methanesulfonic acid, trifluoro-, magnesium salt,magnesiumtrifluoromethanesulfonate,magnesium trifiate,acmc-209mmv,ksc352a4p |
| IUPAC Name | magnesium;trifluoromethanesulfonate |
| InChI Key | BZQRBEVTLZHKEA-UHFFFAOYSA-L |
| Molecular Formula | C2F6MgO6S2 |
Chloroacetic anhydride, 97%
CAS: 541-88-8 Molecular Formula: C4H4Cl2O3 Molecular Weight (g/mol): 170.97 MDL Number: MFCD00000929 InChI Key: PNVPNXKRAUBJGW-UHFFFAOYSA-N Synonym: chloroacetic anhydride,chloracetic anhydride,monochloroacetic acid anhydride,2-chloroacetic anhydride,chloroacetic acid anhydride,chloroacetyl anhydride,acetic acid, chloro-, anhydride,unii-8q7txh7r5f,monochloroacetic anhydride,8q7txh7r5f PubChem CID: 10946 IUPAC Name: (2-chloroacetyl) 2-chloroacetate SMILES: ClCC(=O)OC(=O)CCl
| PubChem CID | 10946 |
|---|---|
| CAS | 541-88-8 |
| Molecular Weight (g/mol) | 170.97 |
| MDL Number | MFCD00000929 |
| SMILES | ClCC(=O)OC(=O)CCl |
| Synonym | chloroacetic anhydride,chloracetic anhydride,monochloroacetic acid anhydride,2-chloroacetic anhydride,chloroacetic acid anhydride,chloroacetyl anhydride,acetic acid, chloro-, anhydride,unii-8q7txh7r5f,monochloroacetic anhydride,8q7txh7r5f |
| IUPAC Name | (2-chloroacetyl) 2-chloroacetate |
| InChI Key | PNVPNXKRAUBJGW-UHFFFAOYSA-N |
| Molecular Formula | C4H4Cl2O3 |
Methyl 3,4-diaminobenzoate, 98%
CAS: 36692-49-6 Molecular Formula: C8H10N2O2 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00017098 InChI Key: IOPLHGOSNCJOOO-UHFFFAOYSA-N Synonym: 3,4-diaminobenzoic acid methyl ester,methyl3,4-diaminobenzoate,methyl-3,4-diaminobenzoate,benzoic acid, 3,4-diamino-, methyl ester,3,4-diamino-benzoic acid methyl ester,methyl 3,4-diaminobenzenecarboxylate,pubchem4610,acmc-1bn7s,methyl 3,4-diamino-benzoate,methyl-3,4-diamino-benzoate PubChem CID: 135524 IUPAC Name: methyl 3,4-diaminobenzoate SMILES: COC(=O)C1=CC=C(N)C(N)=C1
| PubChem CID | 135524 |
|---|---|
| CAS | 36692-49-6 |
| Molecular Weight (g/mol) | 166.18 |
| MDL Number | MFCD00017098 |
| SMILES | COC(=O)C1=CC=C(N)C(N)=C1 |
| Synonym | 3,4-diaminobenzoic acid methyl ester,methyl3,4-diaminobenzoate,methyl-3,4-diaminobenzoate,benzoic acid, 3,4-diamino-, methyl ester,3,4-diamino-benzoic acid methyl ester,methyl 3,4-diaminobenzenecarboxylate,pubchem4610,acmc-1bn7s,methyl 3,4-diamino-benzoate,methyl-3,4-diamino-benzoate |
| IUPAC Name | methyl 3,4-diaminobenzoate |
| InChI Key | IOPLHGOSNCJOOO-UHFFFAOYSA-N |
| Molecular Formula | C8H10N2O2 |
Ethyl diacetoacetate, 97%
CAS: 603-69-0 Molecular Formula: C8H12O4 Molecular Weight (g/mol): 172.18 MDL Number: MFCD00009864 InChI Key: YMCDYRGMTRCAPZ-UHFFFAOYSA-N PubChem CID: 79063 IUPAC Name: ethyl 2-acetyl-3-oxobutanoate SMILES: CCOC(=O)C(C(=O)C)C(=O)C
| PubChem CID | 79063 |
|---|---|
| CAS | 603-69-0 |
| Molecular Weight (g/mol) | 172.18 |
| MDL Number | MFCD00009864 |
| SMILES | CCOC(=O)C(C(=O)C)C(=O)C |
| IUPAC Name | ethyl 2-acetyl-3-oxobutanoate |
| InChI Key | YMCDYRGMTRCAPZ-UHFFFAOYSA-N |
| Molecular Formula | C8H12O4 |
Isopropyl Palmitate, NF, 90%, Spectrum™ Chemical
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CAS: 142-91-6 Molecular Formula: C19H38O2 Molecular Weight (g/mol): 298.51 MDL Number: MFCD00008993 InChI Key: XUGNVMKQXJXZCD-UHFFFAOYSA-N IUPAC Name: propan-2-yl hexadecanoate SMILES: CCCCCCCCCCCCCCCC(=O)OC(C)C
| CAS | 142-91-6 |
|---|---|
| Molecular Weight (g/mol) | 298.51 |
| MDL Number | MFCD00008993 |
| SMILES | CCCCCCCCCCCCCCCC(=O)OC(C)C |
| IUPAC Name | propan-2-yl hexadecanoate |
| InChI Key | XUGNVMKQXJXZCD-UHFFFAOYSA-N |
| Molecular Formula | C19H38O2 |