Carboxylic acids and derivatives
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2-(Dimethylcarbamoyl)benzeneboronic acid, 95%
CAS: 874219-16-6 Molecular Formula: C9H12BNO3 Molecular Weight (g/mol): 193.009 MDL Number: MFCD03425959 InChI Key: NZIOVLXULSCCSG-UHFFFAOYSA-N Synonym: 2-dimethylcarbamoyl phenyl boronic acid,2-n,n-dimethylaminocarbonyl phenylboronic acid,2-dimethylcarbamoyl phenylboronic acid,2-dimethylaminocarbonyl benzeneboronic acid,boronic acid,b-2-dimethylamino carbonyl phenyl,2-dimethylcarbamoyl benzeneboronic acid,acmc-209qkh,2-n,n-dimethylaminocarbonyl benzeneboronic acid,2-dimethylcarbamoyl phenyl boronicacid PubChem CID: 44119823 IUPAC Name: [2-(dimethylcarbamoyl)phenyl]boronic acid SMILES: B(C1=CC=CC=C1C(=O)N(C)C)(O)O
| PubChem CID | 44119823 |
|---|---|
| CAS | 874219-16-6 |
| Molecular Weight (g/mol) | 193.009 |
| MDL Number | MFCD03425959 |
| SMILES | B(C1=CC=CC=C1C(=O)N(C)C)(O)O |
| Synonym | 2-dimethylcarbamoyl phenyl boronic acid,2-n,n-dimethylaminocarbonyl phenylboronic acid,2-dimethylcarbamoyl phenylboronic acid,2-dimethylaminocarbonyl benzeneboronic acid,boronic acid,b-2-dimethylamino carbonyl phenyl,2-dimethylcarbamoyl benzeneboronic acid,acmc-209qkh,2-n,n-dimethylaminocarbonyl benzeneboronic acid,2-dimethylcarbamoyl phenyl boronicacid |
| IUPAC Name | [2-(dimethylcarbamoyl)phenyl]boronic acid |
| InChI Key | NZIOVLXULSCCSG-UHFFFAOYSA-N |
| Molecular Formula | C9H12BNO3 |
5-Hexenyl acetate, 97%
CAS: 5048-26-0 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.20 MDL Number: MFCD00060856 InChI Key: MPLWNENKBSBMFN-UHFFFAOYSA-N Synonym: 5-hexenyl acetate,hex-5-en-1-yl acetate,acetic acid 5-hexenyl ester,5-hexen-1-ol, acetate,5-hexene-1-ol, acetate,acetic acid 5-hexen-1-yl ester,6-acetoxy-1-hexene,6-acetoxyhex-1-ene,5-hexenyl acetate #,acmc-1aw0j PubChem CID: 537536 IUPAC Name: hex-5-enyl acetate SMILES: CC(=O)OCCCCC=C
| PubChem CID | 537536 |
|---|---|
| CAS | 5048-26-0 |
| Molecular Weight (g/mol) | 142.20 |
| MDL Number | MFCD00060856 |
| SMILES | CC(=O)OCCCCC=C |
| Synonym | 5-hexenyl acetate,hex-5-en-1-yl acetate,acetic acid 5-hexenyl ester,5-hexen-1-ol, acetate,5-hexene-1-ol, acetate,acetic acid 5-hexen-1-yl ester,6-acetoxy-1-hexene,6-acetoxyhex-1-ene,5-hexenyl acetate #,acmc-1aw0j |
| IUPAC Name | hex-5-enyl acetate |
| InChI Key | MPLWNENKBSBMFN-UHFFFAOYSA-N |
| Molecular Formula | C8H14O2 |
N-Acetylethylenediamine, tech. 90%
CAS: 1001-53-2 Molecular Formula: C4H10N2O Molecular Weight (g/mol): 102.137 MDL Number: MFCD00008163 InChI Key: DAKZISABEDGGSV-UHFFFAOYSA-N Synonym: n-2-aminoethyl acetamide,n-acetylethylenediamine,acetamide, n-2-aminoethyl,n-2-amino-ethyl-acetamide,unii-fql33v3kzd,fql33v3kzd,acetylethylenediamine,2-acetamidoethylamine,acetylethylene diamine,n-acetylethylendiamine PubChem CID: 66082 IUPAC Name: N-(2-aminoethyl)acetamide SMILES: CC(=O)NCCN
| PubChem CID | 66082 |
|---|---|
| CAS | 1001-53-2 |
| Molecular Weight (g/mol) | 102.137 |
| MDL Number | MFCD00008163 |
| SMILES | CC(=O)NCCN |
| Synonym | n-2-aminoethyl acetamide,n-acetylethylenediamine,acetamide, n-2-aminoethyl,n-2-amino-ethyl-acetamide,unii-fql33v3kzd,fql33v3kzd,acetylethylenediamine,2-acetamidoethylamine,acetylethylene diamine,n-acetylethylendiamine |
| IUPAC Name | N-(2-aminoethyl)acetamide |
| InChI Key | DAKZISABEDGGSV-UHFFFAOYSA-N |
| Molecular Formula | C4H10N2O |
5-Methylindole-2-carboxylic acid, 99%
CAS: 10241-97-1 Molecular Formula: C10H9NO2 Molecular Weight (g/mol): 175.19 MDL Number: MFCD00047166 InChI Key: DAITVOCMWPNFTL-UHFFFAOYSA-N Synonym: 5-methylindole-2-carboxylic acid,5-methyl-2-indolecarboxylic acid,chembl23328,1h-indole-2-carboxylic acid, 5-methyl,acmc-1bxae,5-me-ica,daitvocmwpnftl-uhfffaoysa,5-methyl indole-2-carboxylic acid,1h-indole-2-carboxylicacid, 5-methyl,# PubChem CID: 259188 IUPAC Name: 5-methyl-1H-indole-2-carboxylic acid SMILES: CC1=CC=C2NC(=CC2=C1)C(O)=O
| PubChem CID | 259188 |
|---|---|
| CAS | 10241-97-1 |
| Molecular Weight (g/mol) | 175.19 |
| MDL Number | MFCD00047166 |
| SMILES | CC1=CC=C2NC(=CC2=C1)C(O)=O |
| Synonym | 5-methylindole-2-carboxylic acid,5-methyl-2-indolecarboxylic acid,chembl23328,1h-indole-2-carboxylic acid, 5-methyl,acmc-1bxae,5-me-ica,daitvocmwpnftl-uhfffaoysa,5-methyl indole-2-carboxylic acid,1h-indole-2-carboxylicacid, 5-methyl,# |
| IUPAC Name | 5-methyl-1H-indole-2-carboxylic acid |
| InChI Key | DAITVOCMWPNFTL-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO2 |
TraceCERT™ Extractables And Leachables Screening Standard for LC, Certified Reference Material, MilliporeSigma™ Supelco™
This certified reference material (CRM) is produced and certified in accordance with ISO/IEC 17025 and ISO 17034. This CRM is traceable to the SI through a primary reference material from a NMI. Certified content incl. uncertainty and expiry date are stated on the enclosed certificate.
| Health Hazard 1 | H225 - H302 + H312 + H332 - H319 |
|---|---|
| UN Number | UN 1648 3/PGII |
| Grade | Trace CERT |
| Recommended Storage | -20°C |
| Shelf Life | Limited shelf life, expiry date on the label |
Ethyl 3-hexenoate, 98%
CAS: 2396-83-0 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.20 MDL Number: MFCD00036524 InChI Key: VTSFIPHRNAESED-AATRIKPKSA-N Synonym: ethyl 3-hexenoate,3-hexenoic acid, ethyl ester,ethyl hex-3-enoate,ethyl e-hex-3-enoate,3-hexenoic acid, ethyl ester, e,ethyl trans-3-hexenoate,ethyl e-3-hexenoate,e-3-hexenoic acid ethyl ester,ethyl hydrosorbate,3-hexenoic acid, ethyl ester, 3e PubChem CID: 5362622 IUPAC Name: ethyl (E)-hex-3-enoate SMILES: CCOC(=O)C\C=C\CC
| PubChem CID | 5362622 |
|---|---|
| CAS | 2396-83-0 |
| Molecular Weight (g/mol) | 142.20 |
| MDL Number | MFCD00036524 |
| SMILES | CCOC(=O)C\C=C\CC |
| Synonym | ethyl 3-hexenoate,3-hexenoic acid, ethyl ester,ethyl hex-3-enoate,ethyl e-hex-3-enoate,3-hexenoic acid, ethyl ester, e,ethyl trans-3-hexenoate,ethyl e-3-hexenoate,e-3-hexenoic acid ethyl ester,ethyl hydrosorbate,3-hexenoic acid, ethyl ester, 3e |
| IUPAC Name | ethyl (E)-hex-3-enoate |
| InChI Key | VTSFIPHRNAESED-AATRIKPKSA-N |
| Molecular Formula | C8H14O2 |
3,4,6-Tri-O-benzoyl-D-glucal, 97%
CAS: 13322-90-2 Molecular Formula: C27H22O7 Molecular Weight (g/mol): 458.466 MDL Number: MFCD00061643 InChI Key: OZFFEFRJEYIEGH-SMIHKQSGSA-N Synonym: 3,4,6-tri-o-benzoyl-d-glucal,tri-o-benzoyl-d-glucal,1,2-dideoxy-d-arabino-1-hexenopyranose 3,4,6-tribenzoate,2r,3s,4r-3,4-bis benzoyloxy-3,4-dihydro-2h-pyran-2-yl methyl benzoate PubChem CID: 11134283 IUPAC Name: [(2R,3S,4R)-3,4-dibenzoyloxy-3,4-dihydro-2H-pyran-2-yl]methyl benzoate SMILES: C1=CC=C(C=C1)C(=O)OCC2C(C(C=CO2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4
| PubChem CID | 11134283 |
|---|---|
| CAS | 13322-90-2 |
| Molecular Weight (g/mol) | 458.466 |
| MDL Number | MFCD00061643 |
| SMILES | C1=CC=C(C=C1)C(=O)OCC2C(C(C=CO2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4 |
| Synonym | 3,4,6-tri-o-benzoyl-d-glucal,tri-o-benzoyl-d-glucal,1,2-dideoxy-d-arabino-1-hexenopyranose 3,4,6-tribenzoate,2r,3s,4r-3,4-bis benzoyloxy-3,4-dihydro-2h-pyran-2-yl methyl benzoate |
| IUPAC Name | [(2R,3S,4R)-3,4-dibenzoyloxy-3,4-dihydro-2H-pyran-2-yl]methyl benzoate |
| InChI Key | OZFFEFRJEYIEGH-SMIHKQSGSA-N |
| Molecular Formula | C27H22O7 |
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 |
1,1-Cyclopropanedicarboxylic acid monomethyl ester, 97%
CAS: 113020-21-6 Molecular Formula: C6H8O4 Molecular Weight (g/mol): 144.126 MDL Number: MFCD06800496 InChI Key: IZYOHLOUZVEIOS-UHFFFAOYSA-N Synonym: 1-methoxycarbonyl cyclopropanecarboxylic acid,1,1-cyclopropanedicarboxylic acid monomethyl ester,1-methoxycarbonyl cyclopropane-1-carboxylic acid,cyclopropane-1,1-dicarboxylic acid, methyl ester,1-methoxycarbonylcyclopropanecarboxylic acid,1,1-cyclopropanedicarboxylic acid-1-methyl ester,1-methoxycarbonyl cyclopropanecarboxylicacid,acmc-1c7y7,methyl cyclopropane-1,1-dicarboxylate,1-methoxycarbonylcyclopropane carboxylic acid PubChem CID: 13861823 IUPAC Name: 1-methoxycarbonylcyclopropane-1-carboxylic acid SMILES: COC(=O)C1(CC1)C(=O)O
| PubChem CID | 13861823 |
|---|---|
| CAS | 113020-21-6 |
| Molecular Weight (g/mol) | 144.126 |
| MDL Number | MFCD06800496 |
| SMILES | COC(=O)C1(CC1)C(=O)O |
| Synonym | 1-methoxycarbonyl cyclopropanecarboxylic acid,1,1-cyclopropanedicarboxylic acid monomethyl ester,1-methoxycarbonyl cyclopropane-1-carboxylic acid,cyclopropane-1,1-dicarboxylic acid, methyl ester,1-methoxycarbonylcyclopropanecarboxylic acid,1,1-cyclopropanedicarboxylic acid-1-methyl ester,1-methoxycarbonyl cyclopropanecarboxylicacid,acmc-1c7y7,methyl cyclopropane-1,1-dicarboxylate,1-methoxycarbonylcyclopropane carboxylic acid |
| IUPAC Name | 1-methoxycarbonylcyclopropane-1-carboxylic acid |
| InChI Key | IZYOHLOUZVEIOS-UHFFFAOYSA-N |
| Molecular Formula | C6H8O4 |
3-(4-Biphenyl)propionic acid, 98%
CAS: 35888-99-4 Molecular Formula: C15H14O2 Molecular Weight (g/mol): 226.28 MDL Number: MFCD06823979 InChI Key: MVFHRQWYCXYYMU-UHFFFAOYSA-N Synonym: 2 4-biphenyl propionic acid,3-4-phenylphenyl propanoic acid,3-4-biphenyl propionic acid,3-1,1'-biphenyl-4-yl propanoic acid,3-biphenyl-4-yl propanoic acid,1,1'-biphenyl-4-propanoic acid,2 para-biphenyl propionic acid,biphenyl-4-propanoic acid PubChem CID: 3082434 IUPAC Name: 3-(4-phenylphenyl)propanoic acid SMILES: OC(=O)CCC1=CC=C(C=C1)C1=CC=CC=C1
| PubChem CID | 3082434 |
|---|---|
| CAS | 35888-99-4 |
| Molecular Weight (g/mol) | 226.28 |
| MDL Number | MFCD06823979 |
| SMILES | OC(=O)CCC1=CC=C(C=C1)C1=CC=CC=C1 |
| Synonym | 2 4-biphenyl propionic acid,3-4-phenylphenyl propanoic acid,3-4-biphenyl propionic acid,3-1,1'-biphenyl-4-yl propanoic acid,3-biphenyl-4-yl propanoic acid,1,1'-biphenyl-4-propanoic acid,2 para-biphenyl propionic acid,biphenyl-4-propanoic acid |
| IUPAC Name | 3-(4-phenylphenyl)propanoic acid |
| InChI Key | MVFHRQWYCXYYMU-UHFFFAOYSA-N |
| Molecular Formula | C15H14O2 |
Zinc acetate, anhydrous, 99.9+%
CAS: 557-34-6 Molecular Formula: C4H6O4Zn Molecular Weight (g/mol): 183.468 MDL Number: MFCD00012454 InChI Key: DJWUNCQRNNEAKC-UHFFFAOYSA-L Synonym: zinc acetate,zinc diacetate,zinc ii acetate,acetic acid, zinc salt,dicarbomethoxyzinc,acetic acid, zinc ii salt,zinc di acetate,galzin,zinc acetate anhydrous,siltex cl 4 PubChem CID: 11192 ChEBI: CHEBI:62984 IUPAC Name: zinc;diacetate SMILES: CC(=O)[O-].CC(=O)[O-].[Zn+2]
| PubChem CID | 11192 |
|---|---|
| CAS | 557-34-6 |
| Molecular Weight (g/mol) | 183.468 |
| ChEBI | CHEBI:62984 |
| MDL Number | MFCD00012454 |
| SMILES | CC(=O)[O-].CC(=O)[O-].[Zn+2] |
| Synonym | zinc acetate,zinc diacetate,zinc ii acetate,acetic acid, zinc salt,dicarbomethoxyzinc,acetic acid, zinc ii salt,zinc di acetate,galzin,zinc acetate anhydrous,siltex cl 4 |
| IUPAC Name | zinc;diacetate |
| InChI Key | DJWUNCQRNNEAKC-UHFFFAOYSA-L |
| Molecular Formula | C4H6O4Zn |
Terephthalic Dihydrazide, Spectrum™ Chemical
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CAS: 136-64-1
| CAS | 136-64-1 |
|---|
Sodium citrate, 99.8%, For ACS analysis, MP Biomedicals™
CAS: 1545801 Molecular Formula: C6H9Na3O9 Molecular Weight (g/mol): 294.1 InChI Key: NLJMYIDDQXHKNR-UHFFFAOYSA-K Synonym: trisodium citrate dihydrate,sodium citrate dihydrate,sodium citrate tribasic dihydrate,natriumcitrat-dihydrat,sodium citrate hydrate,1,2,3-propanetricarboxylic acid, 2-hydroxy-, trisodium salt, dihydrate,citronensaeure-tri-na-salz-dihydrat,citric acid trisodium salt dihydrate,citric acid, trisodium salt dihydrate,trisodium 2-hydroxypropane-1,2,3-tricarboxylate dihydrate PubChem CID: 71474 ChEBI: CHEBI:32142 IUPAC Name: trisodium;2-hydroxypropane-1,2,3-tricarboxylate;dihydrate SMILES: C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.O.O.[Na+].[Na+].[Na+]
| PubChem CID | 71474 |
|---|---|
| CAS | 1545801 |
| Molecular Weight (g/mol) | 294.1 |
| ChEBI | CHEBI:32142 |
| SMILES | C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.O.O.[Na+].[Na+].[Na+] |
| Synonym | trisodium citrate dihydrate,sodium citrate dihydrate,sodium citrate tribasic dihydrate,natriumcitrat-dihydrat,sodium citrate hydrate,1,2,3-propanetricarboxylic acid, 2-hydroxy-, trisodium salt, dihydrate,citronensaeure-tri-na-salz-dihydrat,citric acid trisodium salt dihydrate,citric acid, trisodium salt dihydrate,trisodium 2-hydroxypropane-1,2,3-tricarboxylate dihydrate |
| IUPAC Name | trisodium;2-hydroxypropane-1,2,3-tricarboxylate;dihydrate |
| InChI Key | NLJMYIDDQXHKNR-UHFFFAOYSA-K |
| Molecular Formula | C6H9Na3O9 |
Ethyl N,N-dimethyloxamate, 98%
CAS: 16703-52-9 Molecular Formula: C6H11NO3 Molecular Weight (g/mol): 145.158 MDL Number: MFCD00015153 InChI Key: HMALWDVRMHVUAW-UHFFFAOYSA-N Synonym: ethyl n,n-dimethyloxamate,ethyl nn-dimethyloxamate,n,n-dimethyl ethyl oxamate,ethyl 2-dimethylamino-2-oxoacetate,acetic acid, dimethylamino oxo-, ethyl ester,ethyl dimethylcarbamoyl formate,oxamic acid, dimethyl-, ethyl ester,acetic acid, 2-dimethylamino-2-oxo-, ethyl ester,ethyl dimethylamino oxoacetate,aethyl-dimethyloxamat PubChem CID: 85553 IUPAC Name: ethyl 2-(dimethylamino)-2-oxoacetate SMILES: CCOC(=O)C(=O)N(C)C
| PubChem CID | 85553 |
|---|---|
| CAS | 16703-52-9 |
| Molecular Weight (g/mol) | 145.158 |
| MDL Number | MFCD00015153 |
| SMILES | CCOC(=O)C(=O)N(C)C |
| Synonym | ethyl n,n-dimethyloxamate,ethyl nn-dimethyloxamate,n,n-dimethyl ethyl oxamate,ethyl 2-dimethylamino-2-oxoacetate,acetic acid, dimethylamino oxo-, ethyl ester,ethyl dimethylcarbamoyl formate,oxamic acid, dimethyl-, ethyl ester,acetic acid, 2-dimethylamino-2-oxo-, ethyl ester,ethyl dimethylamino oxoacetate,aethyl-dimethyloxamat |
| IUPAC Name | ethyl 2-(dimethylamino)-2-oxoacetate |
| InChI Key | HMALWDVRMHVUAW-UHFFFAOYSA-N |
| Molecular Formula | C6H11NO3 |
MilliporeSigma™ Dihydrorhodamine 123, Calbiochem™,
CAS: 109244-58-8 Molecular Formula: C21H18N2O3 Molecular Weight (g/mol): 346.39 MDL Number: MFCD04221428 InChI Key: FNEZBBILNYNQGC-UHFFFAOYSA-N Synonym: dihydrorhodamine 123,dihydrorhodamine,methyl 2-3,6-diamino-9h-xanthen-9-yl benzoate,benzoic acid, 2-3,6-diamino-9h-xanthen-9-yl-, methyl ester,dihydrorhodamine-123 PubChem CID: 105032 IUPAC Name: methyl 2-(3,6-diamino-9H-xanthen-9-yl)benzoate SMILES: COC(=O)C1=CC=CC=C1C1C2=CC=C(N)C=C2OC2=CC(N)=CC=C12
| PubChem CID | 105032 |
|---|---|
| CAS | 109244-58-8 |
| Molecular Weight (g/mol) | 346.39 |
| MDL Number | MFCD04221428 |
| SMILES | COC(=O)C1=CC=CC=C1C1C2=CC=C(N)C=C2OC2=CC(N)=CC=C12 |
| Synonym | dihydrorhodamine 123,dihydrorhodamine,methyl 2-3,6-diamino-9h-xanthen-9-yl benzoate,benzoic acid, 2-3,6-diamino-9h-xanthen-9-yl-, methyl ester,dihydrorhodamine-123 |
| IUPAC Name | methyl 2-(3,6-diamino-9H-xanthen-9-yl)benzoate |
| InChI Key | FNEZBBILNYNQGC-UHFFFAOYSA-N |
| Molecular Formula | C21H18N2O3 |