
Carboxylic acids and derivatives















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Ethyl heptanoate, 98+%
CAS: 106-30-9 Molecular Formula: C9H18O2 Molecular Weight (g/mol): 158.24 MDL Number: MFCD00009538 InChI Key: TVQGDYNRXLTQAP-UHFFFAOYSA-N Synonym: ethyl enanthate,oenanthic ether,wine oil,ethyl heptylate,grape oil,ethyl heptoate,heptanoic acid, ethyl ester,cognac oil,enanthylic ether,ethyl oenanthate PubChem CID: 7797 ChEBI: CHEBI:86618 IUPAC Name: ethyl heptanoate SMILES: CCCCCCC(=O)OCC
PubChem CID | 7797 |
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CAS | 106-30-9 |
Molecular Weight (g/mol) | 158.24 |
ChEBI | CHEBI:86618 |
MDL Number | MFCD00009538 |
SMILES | CCCCCCC(=O)OCC |
Synonym | ethyl enanthate,oenanthic ether,wine oil,ethyl heptylate,grape oil,ethyl heptoate,heptanoic acid, ethyl ester,cognac oil,enanthylic ether,ethyl oenanthate |
IUPAC Name | ethyl heptanoate |
InChI Key | TVQGDYNRXLTQAP-UHFFFAOYSA-N |
Molecular Formula | C9H18O2 |
Methyl 3-aminobenzoate, 98%
CAS: 4518-10-9 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.17 MDL Number: MFCD00017102 InChI Key: VZDNXXPBYLGWOS-UHFFFAOYSA-N Synonym: benzoic acid, 3-amino-, methyl ester,methyl-3-aminobenzoate,3-aminobenzoic acid methyl ester,m-aminobenzoic acid, methyl ester,3-amino-benzoic acid methyl ester,methyl m-aminobenzoate,methyl3-aminobenzoate,methyl-m-aminobenzoate,pubchem16709,acmc-1aeif PubChem CID: 78274 IUPAC Name: methyl 3-aminobenzoate SMILES: COC(=O)C1=CC(=CC=C1)N
PubChem CID | 78274 |
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CAS | 4518-10-9 |
Molecular Weight (g/mol) | 151.17 |
MDL Number | MFCD00017102 |
SMILES | COC(=O)C1=CC(=CC=C1)N |
Synonym | benzoic acid, 3-amino-, methyl ester,methyl-3-aminobenzoate,3-aminobenzoic acid methyl ester,m-aminobenzoic acid, methyl ester,3-amino-benzoic acid methyl ester,methyl m-aminobenzoate,methyl3-aminobenzoate,methyl-m-aminobenzoate,pubchem16709,acmc-1aeif |
IUPAC Name | methyl 3-aminobenzoate |
InChI Key | VZDNXXPBYLGWOS-UHFFFAOYSA-N |
Molecular Formula | C8H9NO2 |
Calcium propionate hydrate, 97%
CAS: 4075-81-4 Molecular Formula: C6H10CaO4 Molecular Weight (g/mol): 186.22 MDL Number: MFCD00167354 InChI Key: BCZXFFBUYPCTSJ-UHFFFAOYSA-L Synonym: calcium propionate,calcium dipropionate,calcium propanoate,mycoban,propanoic acid, calcium salt,bioban-c,caswell no. 151,propionic acid, calcium salt,unii-8ai80040kw,hsdb 907 PubChem CID: 19999 ChEBI: CHEBI:81716 IUPAC Name: calcium;propanoate SMILES: [Ca++].CCC([O-])=O.CCC([O-])=O
PubChem CID | 19999 |
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CAS | 4075-81-4 |
Molecular Weight (g/mol) | 186.22 |
ChEBI | CHEBI:81716 |
MDL Number | MFCD00167354 |
SMILES | [Ca++].CCC([O-])=O.CCC([O-])=O |
Synonym | calcium propionate,calcium dipropionate,calcium propanoate,mycoban,propanoic acid, calcium salt,bioban-c,caswell no. 151,propionic acid, calcium salt,unii-8ai80040kw,hsdb 907 |
IUPAC Name | calcium;propanoate |
InChI Key | BCZXFFBUYPCTSJ-UHFFFAOYSA-L |
Molecular Formula | C6H10CaO4 |
5-Amino-1-methyl-1H-pyrazole-4-carboxamide, Thermo Scientific™
CAS: 18213-75-7 Molecular Formula: C5H8N4O Molecular Weight (g/mol): 140.146 MDL Number: MFCD00111808 InChI Key: JGSQVTVXGXOSCH-UHFFFAOYSA-N PubChem CID: 265696 IUPAC Name: 5-amino-1-methylpyrazole-4-carboxamide SMILES: CN1C(=C(C=N1)C(=O)N)N
PubChem CID | 265696 |
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CAS | 18213-75-7 |
Molecular Weight (g/mol) | 140.146 |
MDL Number | MFCD00111808 |
SMILES | CN1C(=C(C=N1)C(=O)N)N |
IUPAC Name | 5-amino-1-methylpyrazole-4-carboxamide |
InChI Key | JGSQVTVXGXOSCH-UHFFFAOYSA-N |
Molecular Formula | C5H8N4O |
Sodium Citrate USP/FCC Crystal, Macron Fine Chemicals™
CAS: 6132-04-3 Molecular Formula: C6H9Na3O9 Molecular Weight (g/mol): 294.10 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 |
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CAS | 6132-04-3 |
Molecular Weight (g/mol) | 294.10 |
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 |
Sodium Succinate Granular, Macron Fine Chemicals™
CAS: 150-90-3 Molecular Formula: C4H16Na2O10 Molecular Weight (g/mol): 270.142 InChI Key: ZBTUYCUNQBRXOR-UHFFFAOYSA-L Synonym: disodium succinate hexahydrate,sodium succinate hexahydrate,unii-u16qod6c4e,butanedioic acid, disodium salt, hexahydrate,disodium butanedioate hexahydrate,u16qod6c4e,disodium hexahydrate succinate,sodium succinate dibasic hexahydrate,butanedioic acid disodium salt,succinic acid disodium salt hexahydrate PubChem CID: 3083938 ChEBI: CHEBI:63686 IUPAC Name: disodium;butanedioate;hexahydrate SMILES: C(CC(=O)[O-])C(=O)[O-].O.O.O.O.O.O.[Na+].[Na+]
PubChem CID | 3083938 |
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CAS | 150-90-3 |
Molecular Weight (g/mol) | 270.142 |
ChEBI | CHEBI:63686 |
SMILES | C(CC(=O)[O-])C(=O)[O-].O.O.O.O.O.O.[Na+].[Na+] |
Synonym | disodium succinate hexahydrate,sodium succinate hexahydrate,unii-u16qod6c4e,butanedioic acid, disodium salt, hexahydrate,disodium butanedioate hexahydrate,u16qod6c4e,disodium hexahydrate succinate,sodium succinate dibasic hexahydrate,butanedioic acid disodium salt,succinic acid disodium salt hexahydrate |
IUPAC Name | disodium;butanedioate;hexahydrate |
InChI Key | ZBTUYCUNQBRXOR-UHFFFAOYSA-L |
Molecular Formula | C4H16Na2O10 |
Sodium pyruvate, MP Biomedicals™
CAS: 113-24-6 Molecular Formula: C3H3NaO3 Molecular Weight (g/mol): 110.04 MDL Number: MFCD00002586 InChI Key: DAEPDZWVDSPTHF-UHFFFAOYSA-M Synonym: Pyruvic acid sodium salt,2-Oxopropanoic acid sodium salt,α-ketopropionic acid sodium salt
CAS | 113-24-6 |
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Molecular Weight (g/mol) | 110.04 |
MDL Number | MFCD00002586 |
Synonym | Pyruvic acid sodium salt,2-Oxopropanoic acid sodium salt,α-ketopropionic acid sodium salt |
InChI Key | DAEPDZWVDSPTHF-UHFFFAOYSA-M |
Molecular Formula | C3H3NaO3 |
Ethyl propionate
CAS: 105-37-3 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.133 MDL Number: MFCD00009308 InChI Key: FKRCODPIKNYEAC-UHFFFAOYSA-N Synonym: ethyl propionate,propanoic acid, ethyl ester,propionic ester,propionic ether,propionic acid, ethyl ester,ethylpropionate,propionate d'ethyle,propanoic acid ethyl ester,ethyl n-propionate,propionic acid ethyl ester PubChem CID: 7749 ChEBI: CHEBI:41330 IUPAC Name: ethyl propanoate SMILES: CCC(=O)OCC
PubChem CID | 7749 |
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CAS | 105-37-3 |
Molecular Weight (g/mol) | 102.133 |
ChEBI | CHEBI:41330 |
MDL Number | MFCD00009308 |
SMILES | CCC(=O)OCC |
Synonym | ethyl propionate,propanoic acid, ethyl ester,propionic ester,propionic ether,propionic acid, ethyl ester,ethylpropionate,propionate d'ethyle,propanoic acid ethyl ester,ethyl n-propionate,propionic acid ethyl ester |
IUPAC Name | ethyl propanoate |
InChI Key | FKRCODPIKNYEAC-UHFFFAOYSA-N |
Molecular Formula | C5H10O2 |
Pentaerythritol triacrylate, stab. with 4-methoxyphenol
CAS: 3524-68-3 Molecular Formula: C14H18O7 Molecular Weight (g/mol): 298.291 MDL Number: MFCD00009607 InChI Key: HVVWZTWDBSEWIH-UHFFFAOYSA-N Synonym: pentaerythritol triacrylate,peta,pentaerythrityl triacrylate,gafgard 233,kayarad pet 30,sartomer sr 444,aronix m 305,setalux uv 2242,light acrylate pe 3a,p 300 acrylate PubChem CID: 19042 IUPAC Name: [2-(hydroxymethyl)-3-prop-2-enoyloxy-2-(prop-2-enoyloxymethyl)propyl] prop-2-enoate SMILES: C=CC(=O)OCC(CO)(COC(=O)C=C)COC(=O)C=C
PubChem CID | 19042 |
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CAS | 3524-68-3 |
Molecular Weight (g/mol) | 298.291 |
MDL Number | MFCD00009607 |
SMILES | C=CC(=O)OCC(CO)(COC(=O)C=C)COC(=O)C=C |
Synonym | pentaerythritol triacrylate,peta,pentaerythrityl triacrylate,gafgard 233,kayarad pet 30,sartomer sr 444,aronix m 305,setalux uv 2242,light acrylate pe 3a,p 300 acrylate |
IUPAC Name | [2-(hydroxymethyl)-3-prop-2-enoyloxy-2-(prop-2-enoyloxymethyl)propyl] prop-2-enoate |
InChI Key | HVVWZTWDBSEWIH-UHFFFAOYSA-N |
Molecular Formula | C14H18O7 |
Ethylenediaminetetraacetic acid manganese disodium salt hydrate
CAS: 15375-84-5 Molecular Formula: C10H12MnN2Na2O8 Molecular Weight (g/mol): 389.13 MDL Number: MFCD00661156 InChI Key: ZQHKAIDDHTYINE-UHFFFAOYSA-J Synonym: disodium manganese edta,edta disodium manganese salt,disodium manganese ethylenediaminetetraacetate,manganese disodium ethylene diamine tetraacetate,ethylenediaminetetraacetic acid, disodium manganese salt,disodium ethylenedinitrilo tetraacetato manganese,manganate 2-, disodium,glycine,n'-1,2-ethanediylbis n-carboxymethyl-, manganese disodium salt,manganate 2-,n'-1,2-ethanediylbis n-carboxymethyl glycinato 4--n,n',o,o',on,on'-, disodium, oc-6-21 PubChem CID: 5148022 IUPAC Name: 2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]acetic acid;manganese(2+) SMILES: [Na+].[Na+].[Mn++].[O-]C(=O)CN(CCN(CC([O-])=O)CC([O-])=O)CC([O-])=O
PubChem CID | 5148022 |
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CAS | 15375-84-5 |
Molecular Weight (g/mol) | 389.13 |
MDL Number | MFCD00661156 |
SMILES | [Na+].[Na+].[Mn++].[O-]C(=O)CN(CCN(CC([O-])=O)CC([O-])=O)CC([O-])=O |
Synonym | disodium manganese edta,edta disodium manganese salt,disodium manganese ethylenediaminetetraacetate,manganese disodium ethylene diamine tetraacetate,ethylenediaminetetraacetic acid, disodium manganese salt,disodium ethylenedinitrilo tetraacetato manganese,manganate 2-, disodium,glycine,n'-1,2-ethanediylbis n-carboxymethyl-, manganese disodium salt,manganate 2-,n'-1,2-ethanediylbis n-carboxymethyl glycinato 4--n,n',o,o',on,on'-, disodium, oc-6-21 |
IUPAC Name | 2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]acetic acid;manganese(2+) |
InChI Key | ZQHKAIDDHTYINE-UHFFFAOYSA-J |
Molecular Formula | C10H12MnN2Na2O8 |
Trimethylacetic acid, 99%
CAS: 75-98-9 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.133 MDL Number: MFCD00004194 InChI Key: IUGYQRQAERSCNH-UHFFFAOYSA-N Synonym: pivalic acid,trimethylacetic acid,neopentanoic acid,2,2-dimethylpropionic acid,tert-pentanoic acid,propanoic acid, 2,2-dimethyl,versatic 5,kyselina pivalova,acetic acid, trimethyl,alpha,alpha-dimethylpropionic acid PubChem CID: 6417 ChEBI: CHEBI:45133 IUPAC Name: 2,2-dimethylpropanoic acid SMILES: CC(C)(C)C(=O)O
PubChem CID | 6417 |
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CAS | 75-98-9 |
Molecular Weight (g/mol) | 102.133 |
ChEBI | CHEBI:45133 |
MDL Number | MFCD00004194 |
SMILES | CC(C)(C)C(=O)O |
Synonym | pivalic acid,trimethylacetic acid,neopentanoic acid,2,2-dimethylpropionic acid,tert-pentanoic acid,propanoic acid, 2,2-dimethyl,versatic 5,kyselina pivalova,acetic acid, trimethyl,alpha,alpha-dimethylpropionic acid |
IUPAC Name | 2,2-dimethylpropanoic acid |
InChI Key | IUGYQRQAERSCNH-UHFFFAOYSA-N |
Molecular Formula | C5H10O2 |
Benzanilide, 98+%
CAS: 93-98-1 Molecular Formula: C13H11NO Molecular Weight (g/mol): 197.237 MDL Number: MFCD00003069 InChI Key: ZVSKZLHKADLHSD-UHFFFAOYSA-N Synonym: benzanilide,n-benzoylaniline,benzamide, n-phenyl,n-phenyl-benzamide,benzoic acid anilide,unii-ak1b12366o,phenyl-n-benzamide,benzanilid,benzoylanilide,n-benzoyl aniline PubChem CID: 7168 IUPAC Name: N-phenylbenzamide SMILES: C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2
PubChem CID | 7168 |
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CAS | 93-98-1 |
Molecular Weight (g/mol) | 197.237 |
MDL Number | MFCD00003069 |
SMILES | C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2 |
Synonym | benzanilide,n-benzoylaniline,benzamide, n-phenyl,n-phenyl-benzamide,benzoic acid anilide,unii-ak1b12366o,phenyl-n-benzamide,benzanilid,benzoylanilide,n-benzoyl aniline |
IUPAC Name | N-phenylbenzamide |
InChI Key | ZVSKZLHKADLHSD-UHFFFAOYSA-N |
Molecular Formula | C13H11NO |
Ethyl sorbate, 96%
CAS: 2396-84-1 Molecular Formula: C8H12O2 Molecular Weight (g/mol): 140.18 MDL Number: MFCD00009296 InChI Key: OZZYKXXGCOLLLO-TWTPFVCWSA-N Synonym: ethyl sorbate,ethyl 2,4-hexadienoate,ethyl hexa-2,4-dienoate,sorbic acid, ethyl ester,2,4-hexadienoic acid, ethyl ester,ethyl 2e,4e-hexa-2,4-dienoate,ethyl e,e-2,4-hexadienoate,unii-hsr16usg4d,2,4-hexadienoic acid, ethyl ester, 2e,4e,fema no. 2459 PubChem CID: 1550470 IUPAC Name: ethyl (2E,4E)-hexa-2,4-dienoate SMILES: CCOC(=O)\C=C\C=C\C
PubChem CID | 1550470 |
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CAS | 2396-84-1 |
Molecular Weight (g/mol) | 140.18 |
MDL Number | MFCD00009296 |
SMILES | CCOC(=O)\C=C\C=C\C |
Synonym | ethyl sorbate,ethyl 2,4-hexadienoate,ethyl hexa-2,4-dienoate,sorbic acid, ethyl ester,2,4-hexadienoic acid, ethyl ester,ethyl 2e,4e-hexa-2,4-dienoate,ethyl e,e-2,4-hexadienoate,unii-hsr16usg4d,2,4-hexadienoic acid, ethyl ester, 2e,4e,fema no. 2459 |
IUPAC Name | ethyl (2E,4E)-hexa-2,4-dienoate |
InChI Key | OZZYKXXGCOLLLO-TWTPFVCWSA-N |
Molecular Formula | C8H12O2 |
Methyl chloroacetate, 99+%
CAS: 96-34-4 Molecular Formula: C3H5ClO2 Molecular Weight (g/mol): 108.521 MDL Number: MFCD00000931 InChI Key: QABLOFMHHSOFRJ-UHFFFAOYSA-N Synonym: methyl chloroacetate,chloroacetic acid methyl ester,methyl monochloroacetate,methyl chloroethanoate,acetic acid, chloro-, methyl ester,methyl monochloracetate,methyl alpha-chloroacetate,methylchloroacetate,unii-450vsb182i,ccris 7749 PubChem CID: 7295 IUPAC Name: methyl 2-chloroacetate SMILES: COC(=O)CCl
PubChem CID | 7295 |
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CAS | 96-34-4 |
Molecular Weight (g/mol) | 108.521 |
MDL Number | MFCD00000931 |
SMILES | COC(=O)CCl |
Synonym | methyl chloroacetate,chloroacetic acid methyl ester,methyl monochloroacetate,methyl chloroethanoate,acetic acid, chloro-, methyl ester,methyl monochloracetate,methyl alpha-chloroacetate,methylchloroacetate,unii-450vsb182i,ccris 7749 |
IUPAC Name | methyl 2-chloroacetate |
InChI Key | QABLOFMHHSOFRJ-UHFFFAOYSA-N |
Molecular Formula | C3H5ClO2 |