Organic acids and derivatives























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Methyl benzoate, 99%
CAS: 93-58-3 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 InChI Key: QPJVMBTYPHYUOC-UHFFFAOYSA-N Synonym: methylbenzoate,benzoic acid, methyl ester,clorius,benzoic acid methyl ester,niobe oil,oil of niobe,methyl benzenecarboxylate,essence of niobe,oniobe oil,oxidate le PubChem CID: 7150 ChEBI: CHEBI:72775 IUPAC Name: methyl benzoate SMILES: COC(=O)C1=CC=CC=C1
PubChem CID | 7150 |
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CAS | 93-58-3 |
Molecular Weight (g/mol) | 136.15 |
ChEBI | CHEBI:72775 |
SMILES | COC(=O)C1=CC=CC=C1 |
Synonym | methylbenzoate,benzoic acid, methyl ester,clorius,benzoic acid methyl ester,niobe oil,oil of niobe,methyl benzenecarboxylate,essence of niobe,oniobe oil,oxidate le |
IUPAC Name | methyl benzoate |
InChI Key | QPJVMBTYPHYUOC-UHFFFAOYSA-N |
Molecular Formula | C8H8O2 |
1-Octanesulfonic Acid, Sodium Salt Anhydrous, HPLC Grade, Thermo Scientific Chemicals
CAS: 5324-84-5 Molecular Formula: C8H17NaO3S Molecular Weight (g/mol): 216.27 MDL Number: MFCD00007544 InChI Key: HRQDCDQDOPSGBR-UHFFFAOYSA-M Synonym: sodium 1-octanesulfonate,sodium octane-1-sulfonate,1-octanesulfonic acid sodium salt,sodium octanesulfonate,1-octanesulfonic acid, sodium salt,1-octanesulfonate, sodium,sodium octylsulfonate,unii-j46ez5jyb3,octyl sodium sulfonate,ipc-alks-8 PubChem CID: 23669624 IUPAC Name: sodium octane-1-sulfonate SMILES: [Na+].CCCCCCCCS([O-])(=O)=O
PubChem CID | 23669624 |
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CAS | 5324-84-5 |
Molecular Weight (g/mol) | 216.27 |
MDL Number | MFCD00007544 |
SMILES | [Na+].CCCCCCCCS([O-])(=O)=O |
Synonym | sodium 1-octanesulfonate,sodium octane-1-sulfonate,1-octanesulfonic acid sodium salt,sodium octanesulfonate,1-octanesulfonic acid, sodium salt,1-octanesulfonate, sodium,sodium octylsulfonate,unii-j46ez5jyb3,octyl sodium sulfonate,ipc-alks-8 |
IUPAC Name | sodium octane-1-sulfonate |
InChI Key | HRQDCDQDOPSGBR-UHFFFAOYSA-M |
Molecular Formula | C8H17NaO3S |
Thermo Scientific Chemicals Ethylenediaminetetraacetic acid, 99%, pure
CAS: 60-00-4 Molecular Formula: C10H16N2O8 Molecular Weight (g/mol): 292.24 MDL Number: MFCD00003541 InChI Key: KCXVZYZYPLLWCC-UHFFFAOYSA-N Synonym: edta,edetic acid,ethylenediaminetetraacetic acid,edathamil,versene,endrate,havidote,titriplex,edta acid,sequestrol PubChem CID: 6049 ChEBI: CHEBI:42191 IUPAC Name: 2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]acetic acid SMILES: OC(=O)CN(CCN(CC(O)=O)CC(O)=O)CC(O)=O
PubChem CID | 6049 |
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CAS | 60-00-4 |
Molecular Weight (g/mol) | 292.24 |
ChEBI | CHEBI:42191 |
MDL Number | MFCD00003541 |
SMILES | OC(=O)CN(CCN(CC(O)=O)CC(O)=O)CC(O)=O |
Synonym | edta,edetic acid,ethylenediaminetetraacetic acid,edathamil,versene,endrate,havidote,titriplex,edta acid,sequestrol |
IUPAC Name | 2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]acetic acid |
InChI Key | KCXVZYZYPLLWCC-UHFFFAOYSA-N |
Molecular Formula | C10H16N2O8 |
Sodium benzoate, 99%
CAS: 532-32-1 Molecular Formula: C7H5NaO2 Molecular Weight (g/mol): 144.11 MDL Number: MFCD00012463 InChI Key: WXMKPNITSTVMEF-UHFFFAOYSA-M Synonym: sodium benzoate,benzoic acid, sodium salt,benzoic acid sodium salt,sobenate,antimol,benzoate sodium,benzoate of soda,benzoate, sodium,natrium benzoicum,caswell no. 746 PubChem CID: 517055 SMILES: [Na+].[O-]C(=O)C1=CC=CC=C1
PubChem CID | 517055 |
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CAS | 532-32-1 |
Molecular Weight (g/mol) | 144.11 |
MDL Number | MFCD00012463 |
SMILES | [Na+].[O-]C(=O)C1=CC=CC=C1 |
Synonym | sodium benzoate,benzoic acid, sodium salt,benzoic acid sodium salt,sobenate,antimol,benzoate sodium,benzoate of soda,benzoate, sodium,natrium benzoicum,caswell no. 746 |
InChI Key | WXMKPNITSTVMEF-UHFFFAOYSA-M |
Molecular Formula | C7H5NaO2 |
Diethyl bis(hydroxymethyl)malonate, 95%
CAS: 20605-01-0 Molecular Formula: C9H16O6 Molecular Weight (g/mol): 220.221 MDL Number: MFCD00009130 InChI Key: WIOHBOKEUIHYIC-UHFFFAOYSA-N Synonym: diethyl bis hydroxymethyl malonate,diethyl 2,2-bis hydroxymethyl malonate,propanedioic acid, bis hydroxymethyl-, diethyl ester,1,3-diethyl 2,2-bis hydroxymethyl propanedioate,diethyl 2,2-bis hydroxymethyl propanedioate,2,2-bis hydroxymethyl malonic acid diethyl ester,bis hydroxymethyl malonic acid diethyl ester,diethyl 2,2-bis hydroxymethyl propane-1,3-dioate,acmc-20al8x,ksc490a8h PubChem CID: 311844 IUPAC Name: diethyl 2,2-bis(hydroxymethyl)propanedioate SMILES: CCOC(=O)C(CO)(CO)C(=O)OCC
PubChem CID | 311844 |
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CAS | 20605-01-0 |
Molecular Weight (g/mol) | 220.221 |
MDL Number | MFCD00009130 |
SMILES | CCOC(=O)C(CO)(CO)C(=O)OCC |
Synonym | diethyl bis hydroxymethyl malonate,diethyl 2,2-bis hydroxymethyl malonate,propanedioic acid, bis hydroxymethyl-, diethyl ester,1,3-diethyl 2,2-bis hydroxymethyl propanedioate,diethyl 2,2-bis hydroxymethyl propanedioate,2,2-bis hydroxymethyl malonic acid diethyl ester,bis hydroxymethyl malonic acid diethyl ester,diethyl 2,2-bis hydroxymethyl propane-1,3-dioate,acmc-20al8x,ksc490a8h |
IUPAC Name | diethyl 2,2-bis(hydroxymethyl)propanedioate |
InChI Key | WIOHBOKEUIHYIC-UHFFFAOYSA-N |
Molecular Formula | C9H16O6 |
Allyl methacrylate, 98%, stabilized
CAS: 96-05-9 Molecular Formula: C7H10O2 Molecular Weight (g/mol): 126.16 MDL Number: MFCD00008592 InChI Key: FBCQUCJYYPMKRO-UHFFFAOYSA-N Synonym: allyl methacrylate,ageflex ama,methacrylic acid, allyl ester,2-propenoic acid, 2-methyl-, 2-propenyl ester,allylmethacrylate,allyl 2-methylacrylate,allylester kyseliny methakrylove,methacrylic acid allyl ester,unii-g2ig50653z,allylester kyseliny methakrylove czech PubChem CID: 7274 IUPAC Name: prop-2-enyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OCC=C
PubChem CID | 7274 |
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CAS | 96-05-9 |
Molecular Weight (g/mol) | 126.16 |
MDL Number | MFCD00008592 |
SMILES | CC(=C)C(=O)OCC=C |
Synonym | allyl methacrylate,ageflex ama,methacrylic acid, allyl ester,2-propenoic acid, 2-methyl-, 2-propenyl ester,allylmethacrylate,allyl 2-methylacrylate,allylester kyseliny methakrylove,methacrylic acid allyl ester,unii-g2ig50653z,allylester kyseliny methakrylove czech |
IUPAC Name | prop-2-enyl 2-methylprop-2-enoate |
InChI Key | FBCQUCJYYPMKRO-UHFFFAOYSA-N |
Molecular Formula | C7H10O2 |
Sodium 1-octanesulfonate, 99%
CAS: 5324-84-5 Molecular Formula: C8H17NaO3S Molecular Weight (g/mol): 216.27 MDL Number: MFCD00007544 InChI Key: HRQDCDQDOPSGBR-UHFFFAOYSA-M Synonym: sodium 1-octanesulfonate,sodium octane-1-sulfonate,1-octanesulfonic acid sodium salt,sodium octanesulfonate,1-octanesulfonic acid, sodium salt,1-octanesulfonate, sodium,sodium octylsulfonate,unii-j46ez5jyb3,octyl sodium sulfonate,ipc-alks-8 PubChem CID: 23669624 IUPAC Name: sodium;octane-1-sulfonate SMILES: [Na+].CCCCCCCCS([O-])(=O)=O
PubChem CID | 23669624 |
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CAS | 5324-84-5 |
Molecular Weight (g/mol) | 216.27 |
MDL Number | MFCD00007544 |
SMILES | [Na+].CCCCCCCCS([O-])(=O)=O |
Synonym | sodium 1-octanesulfonate,sodium octane-1-sulfonate,1-octanesulfonic acid sodium salt,sodium octanesulfonate,1-octanesulfonic acid, sodium salt,1-octanesulfonate, sodium,sodium octylsulfonate,unii-j46ez5jyb3,octyl sodium sulfonate,ipc-alks-8 |
IUPAC Name | sodium;octane-1-sulfonate |
InChI Key | HRQDCDQDOPSGBR-UHFFFAOYSA-M |
Molecular Formula | C8H17NaO3S |
Taurine, 99%
CAS: 107-35-7 Molecular Formula: C2H7NO3S Molecular Weight (g/mol): 125.14 MDL Number: MFCD00008197 InChI Key: XOAAWQZATWQOTB-UHFFFAOYSA-N Synonym: taurine,tauphon,ethanesulfonic acid, 2-amino,l-taurine,2-aminoethylsulfonic acid,o-due,2-sulfoethylamine,taufon,aminoethanesulfonic acid,aminoethylsulfonic acid PubChem CID: 1123 ChEBI: CHEBI:15891 IUPAC Name: 2-aminoethanesulfonic acid SMILES: NCCS(O)(=O)=O
PubChem CID | 1123 |
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CAS | 107-35-7 |
Molecular Weight (g/mol) | 125.14 |
ChEBI | CHEBI:15891 |
MDL Number | MFCD00008197 |
SMILES | NCCS(O)(=O)=O |
Synonym | taurine,tauphon,ethanesulfonic acid, 2-amino,l-taurine,2-aminoethylsulfonic acid,o-due,2-sulfoethylamine,taufon,aminoethanesulfonic acid,aminoethylsulfonic acid |
IUPAC Name | 2-aminoethanesulfonic acid |
InChI Key | XOAAWQZATWQOTB-UHFFFAOYSA-N |
Molecular Formula | C2H7NO3S |
Ethyl methanesulfonate, 99%
CAS: 62-50-0 Molecular Formula: C3H8O3S Molecular Weight (g/mol): 124.154 MDL Number: MFCD00007559 InChI Key: PLUBXMRUUVWRLT-UHFFFAOYSA-N Synonym: ethyl mesylate,ethyl methanesulphonate,half-myleran,methanesulfonic acid, ethyl ester,methanesulfonic acid ethyl ester,methylsulfonic acid, ethyl ester,rcra waste number u119,ethyl methansulphonate,ethyl ester of methylsulfonic acid,ethyl ester of methanesulfonic acid PubChem CID: 6113 ChEBI: CHEBI:23994 IUPAC Name: ethyl methanesulfonate SMILES: CCOS(=O)(=O)C
PubChem CID | 6113 |
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CAS | 62-50-0 |
Molecular Weight (g/mol) | 124.154 |
ChEBI | CHEBI:23994 |
MDL Number | MFCD00007559 |
SMILES | CCOS(=O)(=O)C |
Synonym | ethyl mesylate,ethyl methanesulphonate,half-myleran,methanesulfonic acid, ethyl ester,methanesulfonic acid ethyl ester,methylsulfonic acid, ethyl ester,rcra waste number u119,ethyl methansulphonate,ethyl ester of methylsulfonic acid,ethyl ester of methanesulfonic acid |
IUPAC Name | ethyl methanesulfonate |
InChI Key | PLUBXMRUUVWRLT-UHFFFAOYSA-N |
Molecular Formula | C3H8O3S |
Methyl methacrylate, 99%, stabilized
CAS: 80-62-6 Molecular Formula: C5H8O2 Molecular Weight (g/mol): 100.12 MDL Number: MFCD00008587 InChI Key: VVQNEPGJFQJSBK-UHFFFAOYSA-N Synonym: methyl methacrylate,methylmethacrylate,methacrylic acid methyl ester,methyl methylacrylate,methyl 2-methylpropenoate,pegalan,methyl-methacrylat,diakon,acryester m,methyl 2-methyl-2-propenoate PubChem CID: 6658 ChEBI: CHEBI:34840 IUPAC Name: methyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OC
PubChem CID | 6658 |
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CAS | 80-62-6 |
Molecular Weight (g/mol) | 100.12 |
ChEBI | CHEBI:34840 |
MDL Number | MFCD00008587 |
SMILES | CC(=C)C(=O)OC |
Synonym | methyl methacrylate,methylmethacrylate,methacrylic acid methyl ester,methyl methylacrylate,methyl 2-methylpropenoate,pegalan,methyl-methacrylat,diakon,acryester m,methyl 2-methyl-2-propenoate |
IUPAC Name | methyl 2-methylprop-2-enoate |
InChI Key | VVQNEPGJFQJSBK-UHFFFAOYSA-N |
Molecular Formula | C5H8O2 |
Diethylenetriaminepentaacetic acid, 98+%
CAS: 67-43-6 Molecular Formula: C14H23N3O10 Molecular Weight (g/mol): 393.34 InChI Key: QPCDCPDFJACHGM-UHFFFAOYSA-N Synonym: pentetic acid,diethylenetriaminepentaacetic acid,dtpa,detapac,complexon v,detarex,perma kleer,titriplex v,monaquest cai,hamp-ex acid PubChem CID: 3053 ChEBI: CHEBI:35739 IUPAC Name: 2-[bis[2-[bis(carboxymethyl)amino]ethyl]amino]acetic acid SMILES: C(CN(CC(=O)O)CC(=O)O)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O
PubChem CID | 3053 |
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CAS | 67-43-6 |
Molecular Weight (g/mol) | 393.34 |
ChEBI | CHEBI:35739 |
SMILES | C(CN(CC(=O)O)CC(=O)O)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O |
Synonym | pentetic acid,diethylenetriaminepentaacetic acid,dtpa,detapac,complexon v,detarex,perma kleer,titriplex v,monaquest cai,hamp-ex acid |
IUPAC Name | 2-[bis[2-[bis(carboxymethyl)amino]ethyl]amino]acetic acid |
InChI Key | QPCDCPDFJACHGM-UHFFFAOYSA-N |
Molecular Formula | C14H23N3O10 |
Ammonium acetate, 97%
CAS: 631-61-8 Molecular Formula: C2H7NO2 Molecular Weight (g/mol): 77.083 MDL Number: MFCD00013066 InChI Key: USFZMSVCRYTOJT-UHFFFAOYSA-N Synonym: ammonium acetate,acetic acid, ammonium salt,azanium acetate,ammoniumacetate,acetic acid ammonium salt,ammonium ethanoate,unii-rre756s6q2,aconh4,ch3coonh4,ch3co2nh4 PubChem CID: 517165 ChEBI: CHEBI:62947 IUPAC Name: azanium;acetate SMILES: CC(=O)[O-].[NH4+]
PubChem CID | 517165 |
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CAS | 631-61-8 |
Molecular Weight (g/mol) | 77.083 |
ChEBI | CHEBI:62947 |
MDL Number | MFCD00013066 |
SMILES | CC(=O)[O-].[NH4+] |
Synonym | ammonium acetate,acetic acid, ammonium salt,azanium acetate,ammoniumacetate,acetic acid ammonium salt,ammonium ethanoate,unii-rre756s6q2,aconh4,ch3coonh4,ch3co2nh4 |
IUPAC Name | azanium;acetate |
InChI Key | USFZMSVCRYTOJT-UHFFFAOYSA-N |
Molecular Formula | C2H7NO2 |
Methyl acetate, 99%
CAS: 79-20-9 Molecular Formula: C3H6O2 Molecular Weight (g/mol): 74.079 MDL Number: MFCD00008711 InChI Key: KXKVLQRXCPHEJC-UHFFFAOYSA-N Synonym: tereton,devoton,acetic acid, methyl ester,methyl ethanoate,acetic acid methyl ester,methylacetat,acetate de methyle,methylacetaat,methyl acetic ester,octan metylu PubChem CID: 6584 ChEBI: CHEBI:77700 IUPAC Name: methyl acetate SMILES: CC(=O)OC
PubChem CID | 6584 |
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CAS | 79-20-9 |
Molecular Weight (g/mol) | 74.079 |
ChEBI | CHEBI:77700 |
MDL Number | MFCD00008711 |
SMILES | CC(=O)OC |
Synonym | tereton,devoton,acetic acid, methyl ester,methyl ethanoate,acetic acid methyl ester,methylacetat,acetate de methyle,methylacetaat,methyl acetic ester,octan metylu |
IUPAC Name | methyl acetate |
InChI Key | KXKVLQRXCPHEJC-UHFFFAOYSA-N |
Molecular Formula | C3H6O2 |
Sodium pyruvate, 99%
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 |
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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 |
Spectinomycin sulfate, 93%
CAS: 23312-56-3 Molecular Formula: C14H26N2O11S Molecular Weight (g/mol): 430.43 MDL Number: MFCD00270185 InChI Key: XGBFWQUQYQIFLB-MTTMTQIXSA-N Synonym: spectinomycin sulfate,spectinomycin sulphate,unii-bz0h4tlf9x,actinospectacin,trobicin,bz0h4tlf9x,togamycin sulfate 1:1,spectinomycin sulfate hydrate,spectinomicina,spectogard PubChem CID: 64771 IUPAC Name: (1R,3S,5R,8R,10R,11S,12S,13R,14S)-8,12,14-trihydroxy-5-methyl-11,13-bis(methylamino)-2,4,9-trioxatricyclo[8.4.0.0³,⁸]tetradecan-7-one; sulfuric acid SMILES: OS(O)(=O)=O.CN[C@@H]1[C@H](O)[C@H](NC)[C@H]2O[C@]3(O)[C@@H](O[C@H](C)CC3=O)O[C@@H]2[C@H]1O
PubChem CID | 64771 |
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CAS | 23312-56-3 |
Molecular Weight (g/mol) | 430.43 |
MDL Number | MFCD00270185 |
SMILES | OS(O)(=O)=O.CN[C@@H]1[C@H](O)[C@H](NC)[C@H]2O[C@]3(O)[C@@H](O[C@H](C)CC3=O)O[C@@H]2[C@H]1O |
Synonym | spectinomycin sulfate,spectinomycin sulphate,unii-bz0h4tlf9x,actinospectacin,trobicin,bz0h4tlf9x,togamycin sulfate 1:1,spectinomycin sulfate hydrate,spectinomicina,spectogard |
IUPAC Name | (1R,3S,5R,8R,10R,11S,12S,13R,14S)-8,12,14-trihydroxy-5-methyl-11,13-bis(methylamino)-2,4,9-trioxatricyclo[8.4.0.0³,⁸]tetradecan-7-one; sulfuric acid |
InChI Key | XGBFWQUQYQIFLB-MTTMTQIXSA-N |
Molecular Formula | C14H26N2O11S |