Organic acids and derivatives
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Ethyl 2,2-diethylacetoacetate, 97%
CAS: 1619-57-4 Molecular Formula: C10H18O3 Molecular Weight (g/mol): 186.251 MDL Number: MFCD00048552 InChI Key: WEIQRLLXVVSKIL-UHFFFAOYSA-N Synonym: ethyl 2,2-diethylacetoacetate,butanoic acid, 2,2-diethyl-3-oxo-, ethyl ester,diethyl acetoacetate,acmc-20al1q,acetoacetic acid, 2,2-diethyl-, ethyl ester,2,2-diethylacetoacetic acid ethyl ester,2-ethyl-2-acetylbutyric acid ethyl ester,2,2-diethyl-3-oxo-butyric acid ethyl ester,butanoic acid,2,2-diethyl-3-oxo-, ethyl ester PubChem CID: 538781 IUPAC Name: ethyl 2,2-diethyl-3-oxobutanoate SMILES: CCC(CC)(C(=O)C)C(=O)OCC
| PubChem CID | 538781 |
|---|---|
| CAS | 1619-57-4 |
| Molecular Weight (g/mol) | 186.251 |
| MDL Number | MFCD00048552 |
| SMILES | CCC(CC)(C(=O)C)C(=O)OCC |
| Synonym | ethyl 2,2-diethylacetoacetate,butanoic acid, 2,2-diethyl-3-oxo-, ethyl ester,diethyl acetoacetate,acmc-20al1q,acetoacetic acid, 2,2-diethyl-, ethyl ester,2,2-diethylacetoacetic acid ethyl ester,2-ethyl-2-acetylbutyric acid ethyl ester,2,2-diethyl-3-oxo-butyric acid ethyl ester,butanoic acid,2,2-diethyl-3-oxo-, ethyl ester |
| IUPAC Name | ethyl 2,2-diethyl-3-oxobutanoate |
| InChI Key | WEIQRLLXVVSKIL-UHFFFAOYSA-N |
| Molecular Formula | C10H18O3 |
2,2,2-Trifluoro-N-methylacetamide, 98%
CAS: 815-06-5 Molecular Formula: C3H4F3NO Molecular Weight (g/mol): 127.066 MDL Number: MFCD00009670 InChI Key: IQNHBUQSOSYAJU-UHFFFAOYSA-N Synonym: n-methyltrifluoroacetamide,n-methyl-2,2,2-trifluoroacetamide,acetamide, 2,2,2-trifluoro-n-methyl,2,2,2-trifluoro-n-methyl-acetamide,n-metnyl-2,2,2-trifluoroacetamide,methyltrifluoroacetamide,acmc-209plm,n-methyl-trifluoroacetamide,n-methyltrifluoro-acetamide PubChem CID: 69948 IUPAC Name: 2,2,2-trifluoro-N-methylacetamide SMILES: CNC(=O)C(F)(F)F
| PubChem CID | 69948 |
|---|---|
| CAS | 815-06-5 |
| Molecular Weight (g/mol) | 127.066 |
| MDL Number | MFCD00009670 |
| SMILES | CNC(=O)C(F)(F)F |
| Synonym | n-methyltrifluoroacetamide,n-methyl-2,2,2-trifluoroacetamide,acetamide, 2,2,2-trifluoro-n-methyl,2,2,2-trifluoro-n-methyl-acetamide,n-metnyl-2,2,2-trifluoroacetamide,methyltrifluoroacetamide,acmc-209plm,n-methyl-trifluoroacetamide,n-methyltrifluoro-acetamide |
| IUPAC Name | 2,2,2-trifluoro-N-methylacetamide |
| InChI Key | IQNHBUQSOSYAJU-UHFFFAOYSA-N |
| Molecular Formula | C3H4F3NO |
Triethyl Citrate, FCC, 99-100.5%, Spectrum™ Chemical
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CAS: 77-93-0 Molecular Formula: C12H20O7 Molecular Weight (g/mol): 276.29 InChI Key: DOOTYTYQINUNNV-UHFFFAOYSA-N IUPAC Name: 1,2,3-triethyl 2-hydroxypropane-1,2,3-tricarboxylate SMILES: CCOC(=O)CC(O)(CC(=O)OCC)C(=O)OCC
| CAS | 77-93-0 |
|---|---|
| Molecular Weight (g/mol) | 276.29 |
| SMILES | CCOC(=O)CC(O)(CC(=O)OCC)C(=O)OCC |
| IUPAC Name | 1,2,3-triethyl 2-hydroxypropane-1,2,3-tricarboxylate |
| InChI Key | DOOTYTYQINUNNV-UHFFFAOYSA-N |
| Molecular Formula | C12H20O7 |
Amyl Acetate, 98%, Spectrum™ Chemical
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CAS: 628-63-7 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.19 InChI Key: PGMYKACGEOXYJE-UHFFFAOYSA-N IUPAC Name: pentyl acetate SMILES: CCCCCOC(C)=O
| CAS | 628-63-7 |
|---|---|
| Molecular Weight (g/mol) | 130.19 |
| SMILES | CCCCCOC(C)=O |
| IUPAC Name | pentyl acetate |
| InChI Key | PGMYKACGEOXYJE-UHFFFAOYSA-N |
| Molecular Formula | C7H14O2 |
Amyl Acetate, Technical, Spectrum™ Chemical
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CAS: 628-63-7
| CAS | 628-63-7 |
|---|
3-Aminobenzeneboronic acid monohydrate, 97%
CAS: 206658-89-1 Molecular Formula: C6H10BNO3 Molecular Weight (g/mol): 154.96 MDL Number: MFCD00149554 InChI Key: XAEOVQODHLLNKX-UHFFFAOYSA-N Synonym: 3-aminophenylboronic acid monohydrate,3-aminophenyl boronic acid hydrate,3-aminophenylboronic acid hydrate,3-aminobenzeneboronic acid monohydrate,m-aminophenylboronic acid hydrate,boronic acid, 3-aminophenyl-, monohydrate,3-aminobenzeneboronic acid hydrate,pubchem4016,acmc-1cfgg,3-boronoaniline monohydrate PubChem CID: 14389423 IUPAC Name: (3-aminophenyl)boronic acid;hydrate SMILES: O.NC1=CC=CC(=C1)B(O)O
| PubChem CID | 14389423 |
|---|---|
| CAS | 206658-89-1 |
| Molecular Weight (g/mol) | 154.96 |
| MDL Number | MFCD00149554 |
| SMILES | O.NC1=CC=CC(=C1)B(O)O |
| Synonym | 3-aminophenylboronic acid monohydrate,3-aminophenyl boronic acid hydrate,3-aminophenylboronic acid hydrate,3-aminobenzeneboronic acid monohydrate,m-aminophenylboronic acid hydrate,boronic acid, 3-aminophenyl-, monohydrate,3-aminobenzeneboronic acid hydrate,pubchem4016,acmc-1cfgg,3-boronoaniline monohydrate |
| IUPAC Name | (3-aminophenyl)boronic acid;hydrate |
| InChI Key | XAEOVQODHLLNKX-UHFFFAOYSA-N |
| Molecular Formula | C6H10BNO3 |
2-Chlorobutyramide, 98%, Thermo Scientific Chemicals
CAS: 7462-73-9 Molecular Formula: C4H8ClNO Molecular Weight (g/mol): 121.564 MDL Number: MFCD00041477 InChI Key: VJIOSCMTZVXQQU-UHFFFAOYSA-N Synonym: 2-chlorobutyramide PubChem CID: 344969 IUPAC Name: 2-chlorobutanamide SMILES: CCC(C(=O)N)Cl
| PubChem CID | 344969 |
|---|---|
| CAS | 7462-73-9 |
| Molecular Weight (g/mol) | 121.564 |
| MDL Number | MFCD00041477 |
| SMILES | CCC(C(=O)N)Cl |
| Synonym | 2-chlorobutyramide |
| IUPAC Name | 2-chlorobutanamide |
| InChI Key | VJIOSCMTZVXQQU-UHFFFAOYSA-N |
| Molecular Formula | C4H8ClNO |
5-Chloro-2-methoxybenzeneboronic acid, 97%, Thermo Scientific Chemicals
CAS: 89694-48-4 Molecular Formula: C7H8BClO3 Molecular Weight (g/mol): 186.40 MDL Number: MFCD01318966 InChI Key: FMBVAOHFMSQDGT-UHFFFAOYSA-N Synonym: 5-chloro-2-methoxyphenyl boronic acid,5-chloro-2-methoxybenzeneboronic acid,5-chloro-2-methoxyphenyl boranediol,2-methoxy-5-chlorophenylboronic acid,4-chloroanisole-2-boronic acid,boronic acid, 5-chloro-2-methoxyphenyl,5-chloro-2-methoxyphenylboronicacid,pubchem1782,5-chloro-2-methoxy-phenyl boronic acid PubChem CID: 2735751 IUPAC Name: (5-chloro-2-methoxyphenyl)boronic acid SMILES: COC1=C(C=C(Cl)C=C1)B(O)O
| PubChem CID | 2735751 |
|---|---|
| CAS | 89694-48-4 |
| Molecular Weight (g/mol) | 186.40 |
| MDL Number | MFCD01318966 |
| SMILES | COC1=C(C=C(Cl)C=C1)B(O)O |
| Synonym | 5-chloro-2-methoxyphenyl boronic acid,5-chloro-2-methoxybenzeneboronic acid,5-chloro-2-methoxyphenyl boranediol,2-methoxy-5-chlorophenylboronic acid,4-chloroanisole-2-boronic acid,boronic acid, 5-chloro-2-methoxyphenyl,5-chloro-2-methoxyphenylboronicacid,pubchem1782,5-chloro-2-methoxy-phenyl boronic acid |
| IUPAC Name | (5-chloro-2-methoxyphenyl)boronic acid |
| InChI Key | FMBVAOHFMSQDGT-UHFFFAOYSA-N |
| Molecular Formula | C7H8BClO3 |
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 |
3-Bromopropylboronic acid pinacol ester, 98%
CAS: 124215-44-7 Molecular Formula: C9H18BBrO2 Molecular Weight (g/mol): 248.96 MDL Number: MFCD10567053 InChI Key: CHQXFJUKMDJWHO-UHFFFAOYSA-N Synonym: 2-3-bromopropyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,3-bromopropylboronic acid pinacol ester,1,3,2-dioxaborolane,2-3-bromopropyl-4,4,5,5-tetramethyl,acmc-1c5j4,3-bromopropylboronic acid, pinacol ester,2-3-bromopropyl-4?4?5?5-tetramethyl-1?3?2-dioxaborolane PubChem CID: 14836669 IUPAC Name: 2-(3-bromopropyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: CC1(C)OB(CCCBr)OC1(C)C
| PubChem CID | 14836669 |
|---|---|
| CAS | 124215-44-7 |
| Molecular Weight (g/mol) | 248.96 |
| MDL Number | MFCD10567053 |
| SMILES | CC1(C)OB(CCCBr)OC1(C)C |
| Synonym | 2-3-bromopropyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,3-bromopropylboronic acid pinacol ester,1,3,2-dioxaborolane,2-3-bromopropyl-4,4,5,5-tetramethyl,acmc-1c5j4,3-bromopropylboronic acid, pinacol ester,2-3-bromopropyl-4?4?5?5-tetramethyl-1?3?2-dioxaborolane |
| IUPAC Name | 2-(3-bromopropyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| InChI Key | CHQXFJUKMDJWHO-UHFFFAOYSA-N |
| Molecular Formula | C9H18BBrO2 |
Ethyl 2-amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, 96%
CAS: 4815-29-6 Molecular Formula: C10H13NO2S Molecular Weight (g/mol): 211.28 MDL Number: MFCD00102063 InChI Key: BOJXCJDYZJSPMZ-UHFFFAOYSA-N Synonym: ethyl 2-amino-5,6-dihydro-4h-cyclopenta b thiophene-3-carboxylate,2-amino-5,6-dihydro-4h-cyclopenta b thiophene-3-carboxylic acid ethyl ester,ethyl 2-amino-4h,5h,6h-cyclopenta b thiophene-3-carboxylate,ethyl 2-aminocyclopenta b thiophene-3-carboxylate,ethyl 2-amino-5,6-dihydro-4h-cyclopenta b-thiophene-3-carboxylate,4h-cyclopenta b thiophene-3-carboxylic acid, 2-amino-5,6-dihydro-, ethyl ester,ethyl 2-amino-4,5,6-trihydrocyclopenta 1,2-b thiophene-3-carboxylate,enamine_004067,ethyl 2-aminocyclopentathiophene-3-carboxylate PubChem CID: 264105 IUPAC Name: ethyl 2-amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate SMILES: CCOC(=O)C1=C(N)SC2=C1CCC2
| PubChem CID | 264105 |
|---|---|
| CAS | 4815-29-6 |
| Molecular Weight (g/mol) | 211.28 |
| MDL Number | MFCD00102063 |
| SMILES | CCOC(=O)C1=C(N)SC2=C1CCC2 |
| Synonym | ethyl 2-amino-5,6-dihydro-4h-cyclopenta b thiophene-3-carboxylate,2-amino-5,6-dihydro-4h-cyclopenta b thiophene-3-carboxylic acid ethyl ester,ethyl 2-amino-4h,5h,6h-cyclopenta b thiophene-3-carboxylate,ethyl 2-aminocyclopenta b thiophene-3-carboxylate,ethyl 2-amino-5,6-dihydro-4h-cyclopenta b-thiophene-3-carboxylate,4h-cyclopenta b thiophene-3-carboxylic acid, 2-amino-5,6-dihydro-, ethyl ester,ethyl 2-amino-4,5,6-trihydrocyclopenta 1,2-b thiophene-3-carboxylate,enamine_004067,ethyl 2-aminocyclopentathiophene-3-carboxylate |
| IUPAC Name | ethyl 2-amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
| InChI Key | BOJXCJDYZJSPMZ-UHFFFAOYSA-N |
| Molecular Formula | C10H13NO2S |
Benzo[b]furan-2-boronic acid, 97%
CAS: 98437-24-2 Molecular Formula: C8H7BO3 Molecular Weight (g/mol): 161.95 MDL Number: MFCD00236019 InChI Key: PKRRNTJIHGOMRC-UHFFFAOYSA-N Synonym: benzofuran-2-boronic acid,benzo b furan-2-boronic acid,benzofuran-2-ylboronic acid,2-benzofuranboronic acid,2-benzofuranylboronic acid,2,3-benzo b furan-2-boronic acid,2-boronobenzo b furan,1-benzofuran-2-yl boronic acid,1-benzofuran-2-boronic acid PubChem CID: 2776266 IUPAC Name: 1-benzofuran-2-ylboronic acid SMILES: OB(O)C1=CC2=CC=CC=C2O1
| PubChem CID | 2776266 |
|---|---|
| CAS | 98437-24-2 |
| Molecular Weight (g/mol) | 161.95 |
| MDL Number | MFCD00236019 |
| SMILES | OB(O)C1=CC2=CC=CC=C2O1 |
| Synonym | benzofuran-2-boronic acid,benzo b furan-2-boronic acid,benzofuran-2-ylboronic acid,2-benzofuranboronic acid,2-benzofuranylboronic acid,2,3-benzo b furan-2-boronic acid,2-boronobenzo b furan,1-benzofuran-2-yl boronic acid,1-benzofuran-2-boronic acid |
| IUPAC Name | 1-benzofuran-2-ylboronic acid |
| InChI Key | PKRRNTJIHGOMRC-UHFFFAOYSA-N |
| Molecular Formula | C8H7BO3 |
1-(4-Methylphenyl)-1-cyclopropanecarboxylic acid, 98%
CAS: 83846-66-6 Molecular Formula: C11H12O2 Molecular Weight (g/mol): 176.21 MDL Number: MFCD00066918 InChI Key: AYUGAOYMYXSOKU-UHFFFAOYSA-N Synonym: 1-p-tolyl cyclopropanecarboxylic acid,1-4-methylphenyl cyclopropanecarboxylic acid,1-4-methylphenyl-1-cyclopropanecarboxylic acid,1-4-methylphenyl cyclopropane-1-carboxylic acid,1-p-tolyl-cyclopropanecarboxylic acid,cyclopropanecarboxylic acid, 1-4-methylphenyl,1-p-tolylcyclopropanecarboxylic acid,1-4-methylphenyl-1-cyclopropan carboxylic acid,cyclopropanecarboxylicacid, 1-4-methylphenyl,1-4-methylphenyl-1-cyclopropane carboxylic acid PubChem CID: 98639 IUPAC Name: 1-(4-methylphenyl)cyclopropane-1-carboxylic acid SMILES: CC1=CC=C(C=C1)C2(CC2)C(=O)O
| PubChem CID | 98639 |
|---|---|
| CAS | 83846-66-6 |
| Molecular Weight (g/mol) | 176.21 |
| MDL Number | MFCD00066918 |
| SMILES | CC1=CC=C(C=C1)C2(CC2)C(=O)O |
| Synonym | 1-p-tolyl cyclopropanecarboxylic acid,1-4-methylphenyl cyclopropanecarboxylic acid,1-4-methylphenyl-1-cyclopropanecarboxylic acid,1-4-methylphenyl cyclopropane-1-carboxylic acid,1-p-tolyl-cyclopropanecarboxylic acid,cyclopropanecarboxylic acid, 1-4-methylphenyl,1-p-tolylcyclopropanecarboxylic acid,1-4-methylphenyl-1-cyclopropan carboxylic acid,cyclopropanecarboxylicacid, 1-4-methylphenyl,1-4-methylphenyl-1-cyclopropane carboxylic acid |
| IUPAC Name | 1-(4-methylphenyl)cyclopropane-1-carboxylic acid |
| InChI Key | AYUGAOYMYXSOKU-UHFFFAOYSA-N |
| Molecular Formula | C11H12O2 |
Adipic dihydrazide, 98%
CAS: 1071-93-8 Molecular Formula: C6H14N4O2 Molecular Weight (g/mol): 174.20 MDL Number: MFCD00007614 InChI Key: IBVAQQYNSHJXBV-UHFFFAOYSA-N Synonym: adipic dihydrazide,adipohydrazide,adipic acid dihydrazide,hexanedioic acid, dihydrazide,adipyl hydrazide,hexanediohydrazide,adipic acid, dihydrazide,adipodihydrazide,hexanedioic acid, 1,6-dihydrazide,unii-vk98i9yw5m PubChem CID: 66117 IUPAC Name: hexanedihydrazide SMILES: NNC(=O)CCCCC(=O)NN
| PubChem CID | 66117 |
|---|---|
| CAS | 1071-93-8 |
| Molecular Weight (g/mol) | 174.20 |
| MDL Number | MFCD00007614 |
| SMILES | NNC(=O)CCCCC(=O)NN |
| Synonym | adipic dihydrazide,adipohydrazide,adipic acid dihydrazide,hexanedioic acid, dihydrazide,adipyl hydrazide,hexanediohydrazide,adipic acid, dihydrazide,adipodihydrazide,hexanedioic acid, 1,6-dihydrazide,unii-vk98i9yw5m |
| IUPAC Name | hexanedihydrazide |
| InChI Key | IBVAQQYNSHJXBV-UHFFFAOYSA-N |
| Molecular Formula | C6H14N4O2 |