Carboxylic acids and derivatives
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Calcium citrate tetrahydrate, 96%
CAS: 5785-44-4 Molecular Formula: C12H18Ca3O18 Molecular Weight (g/mol): 570.492 MDL Number: MFCD00150786 InChI Key: LNIZKKFWMDARJV-UHFFFAOYSA-H Synonym: calcium citrate tetrahydrate,unii-mlm29u2x85,calcium citrate usp,tricalcium dicitrate tetrahydrate,citric acid calcium salt,citracal tn,calcium citrate 3:2 , tetrahydrate,acmc-20aliq,ksc493e4f PubChem CID: 5282392 IUPAC Name: tricalcium;2-hydroxypropane-1,2,3-tricarboxylate;tetrahydrate SMILES: C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.O.O.O.O.[Ca+2].[Ca+2].[Ca+2]
| PubChem CID | 5282392 |
|---|---|
| CAS | 5785-44-4 |
| Molecular Weight (g/mol) | 570.492 |
| MDL Number | MFCD00150786 |
| SMILES | C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.O.O.O.O.[Ca+2].[Ca+2].[Ca+2] |
| Synonym | calcium citrate tetrahydrate,unii-mlm29u2x85,calcium citrate usp,tricalcium dicitrate tetrahydrate,citric acid calcium salt,citracal tn,calcium citrate 3:2 , tetrahydrate,acmc-20aliq,ksc493e4f |
| IUPAC Name | tricalcium;2-hydroxypropane-1,2,3-tricarboxylate;tetrahydrate |
| InChI Key | LNIZKKFWMDARJV-UHFFFAOYSA-H |
| Molecular Formula | C12H18Ca3O18 |
Ethylenediamine Tetraacetic Acid Disodium Salt ACS MP Biomedicals
CAS: 6381-92-6 Molecular Formula: C10H18N2Na2O10 Molecular Weight (g/mol): 372.24 MDL Number: MFCD00150037,MFCD00003541 InChI Key: OVBJJZOQPCKUOR-UHFFFAOYSA-L Synonym: edta disodium salt,cal-ex decalcifier,buffer solution, ph 10.00,sodium di ethylenediamine tetraacetate dihydrate,ethylenediamine tetraacetic acid, disodium salt dihydrate,ethylenediamine tetraacetic acid, disodium salt, standard solution,sodium di ethylenediamine tetraacetate standard solution,ethylenedinitrilo tetraacetic acid disodium, dihydrate, reagent, acs PubChem CID: 44120005 IUPAC Name: disodium 2-({2-[(carboxylatomethyl)(carboxymethyl)amino]ethyl}(carboxymethyl)amino)acetate dihydrate SMILES: O.O.[Na+].[Na+].OC(=O)CN(CCN(CC(O)=O)CC([O-])=O)CC([O-])=O
| PubChem CID | 44120005 |
|---|---|
| CAS | 6381-92-6 |
| Molecular Weight (g/mol) | 372.24 |
| MDL Number | MFCD00150037,MFCD00003541 |
| SMILES | O.O.[Na+].[Na+].OC(=O)CN(CCN(CC(O)=O)CC([O-])=O)CC([O-])=O |
| Synonym | edta disodium salt,cal-ex decalcifier,buffer solution, ph 10.00,sodium di ethylenediamine tetraacetate dihydrate,ethylenediamine tetraacetic acid, disodium salt dihydrate,ethylenediamine tetraacetic acid, disodium salt, standard solution,sodium di ethylenediamine tetraacetate standard solution,ethylenedinitrilo tetraacetic acid disodium, dihydrate, reagent, acs |
| IUPAC Name | disodium 2-({2-[(carboxylatomethyl)(carboxymethyl)amino]ethyl}(carboxymethyl)amino)acetate dihydrate |
| InChI Key | OVBJJZOQPCKUOR-UHFFFAOYSA-L |
| Molecular Formula | C10H18N2Na2O10 |
2-Propylpentanoic acid, 99%
CAS: 99-66-1 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.21 MDL Number: MFCD00002672 InChI Key: NIJJYAXOARWZEE-UHFFFAOYSA-N Synonym: valproic acid,dipropylacetic acid,depakene,depakine,2-propylvaleric acid,ergenyl,di-n-propylacetic acid,valproate,mylproin,pentanoic acid, 2-propyl PubChem CID: 3121 ChEBI: CHEBI:39867 IUPAC Name: 2-propylpentanoic acid SMILES: CCCC(CCC)C(O)=O
| PubChem CID | 3121 |
|---|---|
| CAS | 99-66-1 |
| Molecular Weight (g/mol) | 144.21 |
| ChEBI | CHEBI:39867 |
| MDL Number | MFCD00002672 |
| SMILES | CCCC(CCC)C(O)=O |
| Synonym | valproic acid,dipropylacetic acid,depakene,depakine,2-propylvaleric acid,ergenyl,di-n-propylacetic acid,valproate,mylproin,pentanoic acid, 2-propyl |
| IUPAC Name | 2-propylpentanoic acid |
| InChI Key | NIJJYAXOARWZEE-UHFFFAOYSA-N |
| Molecular Formula | C8H16O2 |
N-Benzylacrylamide, 96%
CAS: 13304-62-6 Molecular Formula: C10H11NO Molecular Weight (g/mol): 161.204 MDL Number: MFCD00015333 InChI Key: OHLHOLGYGRKZMU-UHFFFAOYSA-N Synonym: n-benzylacrylamide,2-propenamide, n-phenylmethyl,n-benzyl acrylamide,acmc-20ak6s,enamine_005841 PubChem CID: 139428 IUPAC Name: N-benzylprop-2-enamide SMILES: C=CC(=O)NCC1=CC=CC=C1
| PubChem CID | 139428 |
|---|---|
| CAS | 13304-62-6 |
| Molecular Weight (g/mol) | 161.204 |
| MDL Number | MFCD00015333 |
| SMILES | C=CC(=O)NCC1=CC=CC=C1 |
| Synonym | n-benzylacrylamide,2-propenamide, n-phenylmethyl,n-benzyl acrylamide,acmc-20ak6s,enamine_005841 |
| IUPAC Name | N-benzylprop-2-enamide |
| InChI Key | OHLHOLGYGRKZMU-UHFFFAOYSA-N |
| Molecular Formula | C10H11NO |
Ethylene Glycol Dimethacrylate (stabilized with HQ) 97.0+%, TCI America™
CAS: 97-90-5 Molecular Formula: C10H14O4 Molecular Weight (g/mol): 198.22 MDL Number: MFCD00008590 InChI Key: STVZJERGLQHEKB-UHFFFAOYSA-N Synonym: ethylene glycol dimethacrylate,ethylene dimethacrylate,glycol dimethacrylate,diglycol dimethacrylate,ethanediol dimethacrylate,ethylenedimethyacrylate,ethylene methacrylate,ethyldiol metacrylate,1,2-bis methacryloyloxy ethane,ethylene glycol bis methacrylate PubChem CID: 7355 ChEBI: CHEBI:53436 IUPAC Name: 2-[(2-methylprop-2-enoyl)oxy]ethyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OCCOC(=O)C(C)=C
| PubChem CID | 7355 |
|---|---|
| CAS | 97-90-5 |
| Molecular Weight (g/mol) | 198.22 |
| ChEBI | CHEBI:53436 |
| MDL Number | MFCD00008590 |
| SMILES | CC(=C)C(=O)OCCOC(=O)C(C)=C |
| Synonym | ethylene glycol dimethacrylate,ethylene dimethacrylate,glycol dimethacrylate,diglycol dimethacrylate,ethanediol dimethacrylate,ethylenedimethyacrylate,ethylene methacrylate,ethyldiol metacrylate,1,2-bis methacryloyloxy ethane,ethylene glycol bis methacrylate |
| IUPAC Name | 2-[(2-methylprop-2-enoyl)oxy]ethyl 2-methylprop-2-enoate |
| InChI Key | STVZJERGLQHEKB-UHFFFAOYSA-N |
| Molecular Formula | C10H14O4 |
Ethyl pyruvate, 98%
CAS: 617-35-6 Molecular Formula: C5H8O3 Molecular Weight (g/mol): 116.12 MDL Number: MFCD00009123 InChI Key: XXRCUYVCPSWGCC-UHFFFAOYSA-N Synonym: ethyl pyruvate,ethyl 2-oxopropionate,pyruvic acid, ethyl ester,propanoic acid, 2-oxo-, ethyl ester,pyruvic acid ethyl ester,ethyl pyroracemate,ethyl acetylformate,2-oxo-propionic acid ethyl ester,ethyl pyruvate natural,ethyl alpha-ketopropionate PubChem CID: 12041 IUPAC Name: ethyl 2-oxopropanoate SMILES: CCOC(=O)C(=O)C
| PubChem CID | 12041 |
|---|---|
| CAS | 617-35-6 |
| Molecular Weight (g/mol) | 116.12 |
| MDL Number | MFCD00009123 |
| SMILES | CCOC(=O)C(=O)C |
| Synonym | ethyl pyruvate,ethyl 2-oxopropionate,pyruvic acid, ethyl ester,propanoic acid, 2-oxo-, ethyl ester,pyruvic acid ethyl ester,ethyl pyroracemate,ethyl acetylformate,2-oxo-propionic acid ethyl ester,ethyl pyruvate natural,ethyl alpha-ketopropionate |
| IUPAC Name | ethyl 2-oxopropanoate |
| InChI Key | XXRCUYVCPSWGCC-UHFFFAOYSA-N |
| Molecular Formula | C5H8O3 |
Sodium Pyruvate 97.0+%, TCI America™
CAS: 113-24-6 Molecular Formula: C3H3NaO3 Molecular Weight (g/mol): 110.044 MDL Number: MFCD00002586 InChI Key: DAEPDZWVDSPTHF-UHFFFAOYSA-M Synonym: sodium pyruvate,pyruvic acid sodium salt,sodium 2-oxopropanoate,pyruvic acid, sodium salt,propanoic acid, 2-oxo-, sodium salt,sodium alpha-ketopropionate,pyruvate sodium,unii-pod38aif08,2-oxopropanoic acid sodium salt,pod38aif08 PubChem CID: 23662274 ChEBI: CHEBI:50144 IUPAC Name: sodium;2-oxopropanoate SMILES: CC(=O)C(=O)[O-].[Na+]
| PubChem CID | 23662274 |
|---|---|
| CAS | 113-24-6 |
| Molecular Weight (g/mol) | 110.044 |
| ChEBI | CHEBI:50144 |
| MDL Number | MFCD00002586 |
| SMILES | CC(=O)C(=O)[O-].[Na+] |
| Synonym | sodium pyruvate,pyruvic acid sodium salt,sodium 2-oxopropanoate,pyruvic acid, sodium salt,propanoic acid, 2-oxo-, sodium salt,sodium alpha-ketopropionate,pyruvate sodium,unii-pod38aif08,2-oxopropanoic acid sodium salt,pod38aif08 |
| IUPAC Name | sodium;2-oxopropanoate |
| InChI Key | DAEPDZWVDSPTHF-UHFFFAOYSA-M |
| Molecular Formula | C3H3NaO3 |
Diethyl maleate, 97%
CAS: 141-05-9 Molecular Formula: C8H12O4 Molecular Weight (g/mol): 172.18 MDL Number: MFCD00009191 InChI Key: IEPRKVQEAMIZSS-WAYWQWQTSA-N Synonym: diethyl maleate,ethyl maleate,maleic acid, diethyl ester,diethylmaleate,maleic acid diethyl ester,2-butenedioic acid z-, diethyl ester,diethyl z-but-2-enedioate,diethyl 2z-but-2-enedioate,unii-g81wqb56ol,ccris 941 PubChem CID: 5271566 ChEBI: CHEBI:68508 IUPAC Name: diethyl (Z)-but-2-enedioate SMILES: CCOC(=O)C=CC(=O)OCC
| PubChem CID | 5271566 |
|---|---|
| CAS | 141-05-9 |
| Molecular Weight (g/mol) | 172.18 |
| ChEBI | CHEBI:68508 |
| MDL Number | MFCD00009191 |
| SMILES | CCOC(=O)C=CC(=O)OCC |
| Synonym | diethyl maleate,ethyl maleate,maleic acid, diethyl ester,diethylmaleate,maleic acid diethyl ester,2-butenedioic acid z-, diethyl ester,diethyl z-but-2-enedioate,diethyl 2z-but-2-enedioate,unii-g81wqb56ol,ccris 941 |
| IUPAC Name | diethyl (Z)-but-2-enedioate |
| InChI Key | IEPRKVQEAMIZSS-WAYWQWQTSA-N |
| Molecular Formula | C8H12O4 |
Mercury(II) acetate, 98+%
CAS: 1600-27-7 Molecular Formula: C4H6HgO4 Molecular Weight (g/mol): 318.68 MDL Number: MFCD00012165 InChI Key: BRMYZIKAHFEUFJ-UHFFFAOYSA-L Synonym: mercury 2+ ion acetic acid PubChem CID: 15337 ChEBI: CHEBI:33211 IUPAC Name: mercury(2+);diacetate SMILES: CC(=O)[O-].CC(=O)[O-].[Hg+2]
| PubChem CID | 15337 |
|---|---|
| CAS | 1600-27-7 |
| Molecular Weight (g/mol) | 318.68 |
| ChEBI | CHEBI:33211 |
| MDL Number | MFCD00012165 |
| SMILES | CC(=O)[O-].CC(=O)[O-].[Hg+2] |
| Synonym | mercury 2+ ion acetic acid |
| IUPAC Name | mercury(2+);diacetate |
| InChI Key | BRMYZIKAHFEUFJ-UHFFFAOYSA-L |
| Molecular Formula | C4H6HgO4 |
Erucamide 85.0+%, TCI America™
CAS: 112-84-5 Molecular Formula: C22H43NO Molecular Weight (g/mol): 337.59 MDL Number: MFCD00882379 InChI Key: UAUDZVJPLUQNMU-KTKRTIGZSA-N Synonym: erucamide,erucylamide,z-docos-13-enamide,erucyl amide,cis-13-docosenoamide,erucic acid amide,13-docosenamide, z,cis-13-docosenamide,13-docosenamide,unii-0v89vy25bn PubChem CID: 5365371 IUPAC Name: (13Z)-docos-13-enamide SMILES: CCCCCCCC\C=C/CCCCCCCCCCCC(N)=O
| PubChem CID | 5365371 |
|---|---|
| CAS | 112-84-5 |
| Molecular Weight (g/mol) | 337.59 |
| MDL Number | MFCD00882379 |
| SMILES | CCCCCCCC\C=C/CCCCCCCCCCCC(N)=O |
| Synonym | erucamide,erucylamide,z-docos-13-enamide,erucyl amide,cis-13-docosenoamide,erucic acid amide,13-docosenamide, z,cis-13-docosenamide,13-docosenamide,unii-0v89vy25bn |
| IUPAC Name | (13Z)-docos-13-enamide |
| InChI Key | UAUDZVJPLUQNMU-KTKRTIGZSA-N |
| Molecular Formula | C22H43NO |
Dibutyl maleate, 97%
CAS: 105-76-0 Molecular Formula: C12H20O4 Molecular Weight (g/mol): 228.29 MDL Number: MFCD00009447,MFCD00065141 InChI Key: JBSLOWBPDRZSMB-FPLPWBNLSA-N Synonym: dibutyl maleate,butyl maleate,staflex dbm,rc comonomer dbm,maleic acid, dibutyl ester,di-n-butyl maleate,2-butenedioic acid z-, dibutyl ester,2-butenedioic acid, dibutyl ester,maleic acid dibutyl ester,2-butenedioic acid 2z-, dibutyl ester PubChem CID: 5271569 IUPAC Name: dibutyl (Z)-but-2-enedioate SMILES: CCCCOC(=O)\C=C/C(=O)OCCCC
| PubChem CID | 5271569 |
|---|---|
| CAS | 105-76-0 |
| Molecular Weight (g/mol) | 228.29 |
| MDL Number | MFCD00009447,MFCD00065141 |
| SMILES | CCCCOC(=O)\C=C/C(=O)OCCCC |
| Synonym | dibutyl maleate,butyl maleate,staflex dbm,rc comonomer dbm,maleic acid, dibutyl ester,di-n-butyl maleate,2-butenedioic acid z-, dibutyl ester,2-butenedioic acid, dibutyl ester,maleic acid dibutyl ester,2-butenedioic acid 2z-, dibutyl ester |
| IUPAC Name | dibutyl (Z)-but-2-enedioate |
| InChI Key | JBSLOWBPDRZSMB-FPLPWBNLSA-N |
| Molecular Formula | C12H20O4 |
n-Butyl levulinate, 98%
CAS: 2052-15-5 Molecular Formula: C9H16O3 Molecular Weight (g/mol): 172.224 MDL Number: MFCD00009449 InChI Key: ISBWNEKJSSLXOD-UHFFFAOYSA-N Synonym: butyl levulinate,n-butyl levulinate,butyl laevulinate,pentanoic acid, 4-oxo-, butyl ester,n-butyl laevulinate,levulinic acid, butyl ester,butyl 4-ketovalerate,4-ketopentanoic acid butyl ester,butyl acetylpropionate,n-butyl 4-oxopentanoate PubChem CID: 16331 IUPAC Name: butyl 4-oxopentanoate SMILES: CCCCOC(=O)CCC(=O)C
| PubChem CID | 16331 |
|---|---|
| CAS | 2052-15-5 |
| Molecular Weight (g/mol) | 172.224 |
| MDL Number | MFCD00009449 |
| SMILES | CCCCOC(=O)CCC(=O)C |
| Synonym | butyl levulinate,n-butyl levulinate,butyl laevulinate,pentanoic acid, 4-oxo-, butyl ester,n-butyl laevulinate,levulinic acid, butyl ester,butyl 4-ketovalerate,4-ketopentanoic acid butyl ester,butyl acetylpropionate,n-butyl 4-oxopentanoate |
| IUPAC Name | butyl 4-oxopentanoate |
| InChI Key | ISBWNEKJSSLXOD-UHFFFAOYSA-N |
| Molecular Formula | C9H16O3 |
Phthalimide, 99%
CAS: 85-41-6 Molecular Formula: C8H5NO2 Molecular Weight (g/mol): 147.13 MDL Number: MFCD00005881 InChI Key: XKJCHHZQLQNZHY-UHFFFAOYSA-N Synonym: phthalimide,1h-isoindole-1,3 2h-dione,o-phthalimide,isoindoline-1,3-dione,o-phthalic imide,1,3-isoindolinedione,benzoimide,2-diazoindan-1,3-dione,phenylimide,phthalimid PubChem CID: 6809 ChEBI: CHEBI:38817 IUPAC Name: isoindole-1,3-dione SMILES: O=C1NC(=O)C2=CC=CC=C12
| PubChem CID | 6809 |
|---|---|
| CAS | 85-41-6 |
| Molecular Weight (g/mol) | 147.13 |
| ChEBI | CHEBI:38817 |
| MDL Number | MFCD00005881 |
| SMILES | O=C1NC(=O)C2=CC=CC=C12 |
| Synonym | phthalimide,1h-isoindole-1,3 2h-dione,o-phthalimide,isoindoline-1,3-dione,o-phthalic imide,1,3-isoindolinedione,benzoimide,2-diazoindan-1,3-dione,phenylimide,phthalimid |
| IUPAC Name | isoindole-1,3-dione |
| InChI Key | XKJCHHZQLQNZHY-UHFFFAOYSA-N |
| Molecular Formula | C8H5NO2 |
n-Butyl propionate, 99+%
CAS: 590-01-2 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.19 MDL Number: MFCD00009448 InChI Key: BTMVHUNTONAYDX-UHFFFAOYSA-N Synonym: butyl propionate,n-butyl propionate,propanoic acid, butyl ester,n-butyl propanoate,propionic acid, butyl ester,propionic acid butyl ester,unii-2nxc4ak99e,butyl propionate natural,fema no. 2211,n-butyl n-propionate PubChem CID: 11529 IUPAC Name: butyl propanoate SMILES: CCCCOC(=O)CC
| PubChem CID | 11529 |
|---|---|
| CAS | 590-01-2 |
| Molecular Weight (g/mol) | 130.19 |
| MDL Number | MFCD00009448 |
| SMILES | CCCCOC(=O)CC |
| Synonym | butyl propionate,n-butyl propionate,propanoic acid, butyl ester,n-butyl propanoate,propionic acid, butyl ester,propionic acid butyl ester,unii-2nxc4ak99e,butyl propionate natural,fema no. 2211,n-butyl n-propionate |
| IUPAC Name | butyl propanoate |
| InChI Key | BTMVHUNTONAYDX-UHFFFAOYSA-N |
| Molecular Formula | C7H14O2 |
Ethyl caprate, 99+%
CAS: 110-38-3 Molecular Formula: C12H24O2 Molecular Weight (g/mol): 200.32 MDL Number: MFCD00009581 InChI Key: RGXWDWUGBIJHDO-UHFFFAOYSA-N Synonym: ethyl caprate,ethyl caprinate,ethyl decylate,decanoic acid ethyl ester,decanoic acid, ethyl ester,capric acid ethyl ester,ethyl n-decanoate,capric acid, ethyl ester,natural,unii-gy39fb86uo PubChem CID: 8048 ChEBI: CHEBI:87430 IUPAC Name: ethyl decanoate SMILES: CCCCCCCCCC(=O)OCC
| PubChem CID | 8048 |
|---|---|
| CAS | 110-38-3 |
| Molecular Weight (g/mol) | 200.32 |
| ChEBI | CHEBI:87430 |
| MDL Number | MFCD00009581 |
| SMILES | CCCCCCCCCC(=O)OCC |
| Synonym | ethyl caprate,ethyl caprinate,ethyl decylate,decanoic acid ethyl ester,decanoic acid, ethyl ester,capric acid ethyl ester,ethyl n-decanoate,capric acid, ethyl ester,natural,unii-gy39fb86uo |
| IUPAC Name | ethyl decanoate |
| InChI Key | RGXWDWUGBIJHDO-UHFFFAOYSA-N |
| Molecular Formula | C12H24O2 |