
Organic acids and derivatives























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Ethyl hexanoate, 99%
CAS: 123-66-0 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.214 MDL Number: MFCD00009511 InChI Key: SHZIWNPUGXLXDT-UHFFFAOYSA-N Synonym: ethyl caproate,ethyl hexoate,hexanoic acid, ethyl ester,hexanoic acid ethyl ester,capronic ether absolute,caproic acid ethyl ester,ethyl n-hexanoate,ethyl butyl acetate,caproate,acetic acid, butyl-, ethyl ester PubChem CID: 31265 ChEBI: CHEBI:86055 IUPAC Name: ethyl hexanoate SMILES: CCCCCC(=O)OCC
PubChem CID | 31265 |
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CAS | 123-66-0 |
Molecular Weight (g/mol) | 144.214 |
ChEBI | CHEBI:86055 |
MDL Number | MFCD00009511 |
SMILES | CCCCCC(=O)OCC |
Synonym | ethyl caproate,ethyl hexoate,hexanoic acid, ethyl ester,hexanoic acid ethyl ester,capronic ether absolute,caproic acid ethyl ester,ethyl n-hexanoate,ethyl butyl acetate,caproate,acetic acid, butyl-, ethyl ester |
IUPAC Name | ethyl hexanoate |
InChI Key | SHZIWNPUGXLXDT-UHFFFAOYSA-N |
Molecular Formula | C8H16O2 |
Triethyl citrate, 99%
CAS: 77-93-0 Molecular Formula: C12H20O7 Molecular Weight (g/mol): 276.29 InChI Key: DOOTYTYQINUNNV-UHFFFAOYSA-N Synonym: triethyl citrate,ethyl citrate,citroflex 2,eudraflex,hydragen cat,citric acid, triethyl ester,triaethylcitrat,triethylcitrate,citric acid triethyl ester,1,2,3-propanetricarboxylic acid, 2-hydroxy-, triethyl ester PubChem CID: 6506 IUPAC Name: triethyl 2-hydroxypropane-1,2,3-tricarboxylate SMILES: CCOC(=O)CC(CC(=O)OCC)(C(=O)OCC)O
PubChem CID | 6506 |
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CAS | 77-93-0 |
Molecular Weight (g/mol) | 276.29 |
SMILES | CCOC(=O)CC(CC(=O)OCC)(C(=O)OCC)O |
Synonym | triethyl citrate,ethyl citrate,citroflex 2,eudraflex,hydragen cat,citric acid, triethyl ester,triaethylcitrat,triethylcitrate,citric acid triethyl ester,1,2,3-propanetricarboxylic acid, 2-hydroxy-, triethyl ester |
IUPAC Name | triethyl 2-hydroxypropane-1,2,3-tricarboxylate |
InChI Key | DOOTYTYQINUNNV-UHFFFAOYSA-N |
Molecular Formula | C12H20O7 |
Nicotinamide 99.0+%, TCI America™
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CAS: 98-92-0 Molecular Formula: C6H6N2O Molecular Weight (g/mol): 122.127 MDL Number: MFCD00006395 InChI Key: DFPAKSUCGFBDDF-UHFFFAOYSA-N Synonym: nicotinamide,niacinamide,3-pyridinecarboxamide,vitamin pp,nicotinic acid amide,papulex,aminicotin,amixicotyn,nicobion,nicotylamide PubChem CID: 936 ChEBI: CHEBI:17154 IUPAC Name: pyridine-3-carboxamide SMILES: C1=CC(=CN=C1)C(=O)N
PubChem CID | 936 |
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CAS | 98-92-0 |
Molecular Weight (g/mol) | 122.127 |
ChEBI | CHEBI:17154 |
MDL Number | MFCD00006395 |
SMILES | C1=CC(=CN=C1)C(=O)N |
Synonym | nicotinamide,niacinamide,3-pyridinecarboxamide,vitamin pp,nicotinic acid amide,papulex,aminicotin,amixicotyn,nicobion,nicotylamide |
IUPAC Name | pyridine-3-carboxamide |
InChI Key | DFPAKSUCGFBDDF-UHFFFAOYSA-N |
Molecular Formula | C6H6N2O |
N,N'-Methylenebisacrylamide, 97%
CAS: 110-26-9 Molecular Formula: C7H10N2O2 Molecular Weight (g/mol): 154.169 MDL Number: MFCD00008625 InChI Key: ZIUHHBKFKCYYJD-UHFFFAOYSA-N Synonym: n,n'-methylenebisacrylamide,n,n'-methylenediacrylamide,n,n'-methylene-bis-acrylamide,methylenebisacrylamide,methylenediacrylamide,2-propenamide, n,n'-methylenebis,bis-acrylamide,n,n'-methylenebis acrylamide,n,n'-methylidenebisacrylamide,bisacrylamide PubChem CID: 8041 IUPAC Name: N-[(prop-2-enoylamino)methyl]prop-2-enamide SMILES: C=CC(=O)NCNC(=O)C=C
PubChem CID | 8041 |
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CAS | 110-26-9 |
Molecular Weight (g/mol) | 154.169 |
MDL Number | MFCD00008625 |
SMILES | C=CC(=O)NCNC(=O)C=C |
Synonym | n,n'-methylenebisacrylamide,n,n'-methylenediacrylamide,n,n'-methylene-bis-acrylamide,methylenebisacrylamide,methylenediacrylamide,2-propenamide, n,n'-methylenebis,bis-acrylamide,n,n'-methylenebis acrylamide,n,n'-methylidenebisacrylamide,bisacrylamide |
IUPAC Name | N-[(prop-2-enoylamino)methyl]prop-2-enamide |
InChI Key | ZIUHHBKFKCYYJD-UHFFFAOYSA-N |
Molecular Formula | C7H10N2O2 |
Dimethyl carbonate, 99%
CAS: 616-38-6 Molecular Formula: C3H6O3 Molecular Weight (g/mol): 90.08 MDL Number: MFCD00008420 InChI Key: IEJIGPNLZYLLBP-UHFFFAOYSA-N Synonym: methyl carbonate,carbonic acid, dimethyl ester,carbonic acid dimethyl ester,methyl carbonate meo 2co,unii-ke9j097spn,dimethylcarbonate,ch3ocooch3,ke9j097spn,dimethyl ester of carbonic acid,dsstox_cid_9192 PubChem CID: 12021 ChEBI: CHEBI:36596 IUPAC Name: dimethyl carbonate SMILES: COC(=O)OC
PubChem CID | 12021 |
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CAS | 616-38-6 |
Molecular Weight (g/mol) | 90.08 |
ChEBI | CHEBI:36596 |
MDL Number | MFCD00008420 |
SMILES | COC(=O)OC |
Synonym | methyl carbonate,carbonic acid, dimethyl ester,carbonic acid dimethyl ester,methyl carbonate meo 2co,unii-ke9j097spn,dimethylcarbonate,ch3ocooch3,ke9j097spn,dimethyl ester of carbonic acid,dsstox_cid_9192 |
IUPAC Name | dimethyl carbonate |
InChI Key | IEJIGPNLZYLLBP-UHFFFAOYSA-N |
Molecular Formula | C3H6O3 |
tert-Butyl Acetate 99.0+%, TCI America™
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CAS: 540-88-5 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00008807 InChI Key: WMOVHXAZOJBABW-UHFFFAOYSA-N Synonym: t-butyl acetate,acetic acid tert-butyl ester,tert-butyl ethanoate,acetic acid, 1,1-dimethylethyl ester,texaco lead appreciator,acetic acid, tert-butyl ester,tert-butylacetate,tert butyl acetate,1,1-dimethylethyl acetate,1,1-dimethyl acetate PubChem CID: 10908 IUPAC Name: tert-butyl acetate SMILES: CC(=O)OC(C)(C)C
PubChem CID | 10908 |
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CAS | 540-88-5 |
Molecular Weight (g/mol) | 116.16 |
MDL Number | MFCD00008807 |
SMILES | CC(=O)OC(C)(C)C |
Synonym | t-butyl acetate,acetic acid tert-butyl ester,tert-butyl ethanoate,acetic acid, 1,1-dimethylethyl ester,texaco lead appreciator,acetic acid, tert-butyl ester,tert-butylacetate,tert butyl acetate,1,1-dimethylethyl acetate,1,1-dimethyl acetate |
IUPAC Name | tert-butyl acetate |
InChI Key | WMOVHXAZOJBABW-UHFFFAOYSA-N |
Molecular Formula | C6H12O2 |
EDTA, Disodium Dihydrate, ACS Reagent Grade, Ricca Chemical
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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 |
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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 |
n-Butyl acrylate, 98+%, stab. with up to 50ppm 4-methoxyphenol
CAS: 141-32-2 Molecular Formula: C7H12O2 Molecular Weight (g/mol): 128.171 MDL Number: MFCD00009446 InChI Key: CQEYYJKEWSMYFG-UHFFFAOYSA-N Synonym: butyl acrylate,n-butyl acrylate,acrylic acid butyl ester,n-butyl propenoate,2-propenoic acid, butyl ester,butyl 2-propenoate,butylacrylate,acrylic acid, butyl ester,acrylic acid n-butyl ester,butylester kyseliny akrylove PubChem CID: 8846 ChEBI: CHEBI:3245 IUPAC Name: butyl prop-2-enoate SMILES: CCCCOC(=O)C=C
PubChem CID | 8846 |
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CAS | 141-32-2 |
Molecular Weight (g/mol) | 128.171 |
ChEBI | CHEBI:3245 |
MDL Number | MFCD00009446 |
SMILES | CCCCOC(=O)C=C |
Synonym | butyl acrylate,n-butyl acrylate,acrylic acid butyl ester,n-butyl propenoate,2-propenoic acid, butyl ester,butyl 2-propenoate,butylacrylate,acrylic acid, butyl ester,acrylic acid n-butyl ester,butylester kyseliny akrylove |
IUPAC Name | butyl prop-2-enoate |
InChI Key | CQEYYJKEWSMYFG-UHFFFAOYSA-N |
Molecular Formula | C7H12O2 |
n-Amyl acetate, 99%
CAS: 628-63-7 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.19 MDL Number: MFCD00009500 InChI Key: PGMYKACGEOXYJE-UHFFFAOYSA-N Synonym: amyl acetate,n-amyl acetate,acetic acid, pentyl ester,n-pentyl acetate,amyl acetic ester,1-pentyl acetate,n-pentyl ethanoate,birnenoel,pent-acetate,amyl acetic ether PubChem CID: 12348 ChEBI: CHEBI:87362 IUPAC Name: pentyl acetate SMILES: CCCCCOC(=O)C
PubChem CID | 12348 |
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CAS | 628-63-7 |
Molecular Weight (g/mol) | 130.19 |
ChEBI | CHEBI:87362 |
MDL Number | MFCD00009500 |
SMILES | CCCCCOC(=O)C |
Synonym | amyl acetate,n-amyl acetate,acetic acid, pentyl ester,n-pentyl acetate,amyl acetic ester,1-pentyl acetate,n-pentyl ethanoate,birnenoel,pent-acetate,amyl acetic ether |
IUPAC Name | pentyl acetate |
InChI Key | PGMYKACGEOXYJE-UHFFFAOYSA-N |
Molecular Formula | C7H14O2 |
Isopropyl myristate, 96%
CAS: 110-27-0 Molecular Formula: C17H34O2 Molecular Weight (g/mol): 270.45 MDL Number: MFCD00008982 InChI Key: AXISYYRBXTVTFY-UHFFFAOYSA-N Synonym: isopropyl myristate,isopropyl tetradecanoate,estergel,bisomel,isomyst,promyr,tetradecanoic acid, 1-methylethyl ester,deltyl extra,kesscomir,tegester PubChem CID: 8042 IUPAC Name: propan-2-yl tetradecanoate SMILES: CCCCCCCCCCCCCC(=O)OC(C)C
PubChem CID | 8042 |
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CAS | 110-27-0 |
Molecular Weight (g/mol) | 270.45 |
MDL Number | MFCD00008982 |
SMILES | CCCCCCCCCCCCCC(=O)OC(C)C |
Synonym | isopropyl myristate,isopropyl tetradecanoate,estergel,bisomel,isomyst,promyr,tetradecanoic acid, 1-methylethyl ester,deltyl extra,kesscomir,tegester |
IUPAC Name | propan-2-yl tetradecanoate |
InChI Key | AXISYYRBXTVTFY-UHFFFAOYSA-N |
Molecular Formula | C17H34O2 |
Methyl bromoacetate, 98+%
CAS: 96-32-2 Molecular Formula: C3H5BrO2 Molecular Weight (g/mol): 152.975 MDL Number: MFCD00000189 InChI Key: YDCHPLOFQATIDS-UHFFFAOYSA-N Synonym: methyl bromoacetate,bromoacetic acid methyl ester,methyl monobromoacetate,acetic acid, bromo-, methyl ester,methyl alpha-bromoacetate,methylbromoacetate,acetic acid, 2-bromo-, methyl ester,methylester kyseliny bromoctove,methyl .alpha.-bromoacetate,methylester kyseliny bromoctove czech PubChem CID: 60984 IUPAC Name: methyl 2-bromoacetate SMILES: COC(=O)CBr
PubChem CID | 60984 |
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CAS | 96-32-2 |
Molecular Weight (g/mol) | 152.975 |
MDL Number | MFCD00000189 |
SMILES | COC(=O)CBr |
Synonym | methyl bromoacetate,bromoacetic acid methyl ester,methyl monobromoacetate,acetic acid, bromo-, methyl ester,methyl alpha-bromoacetate,methylbromoacetate,acetic acid, 2-bromo-, methyl ester,methylester kyseliny bromoctove,methyl .alpha.-bromoacetate,methylester kyseliny bromoctove czech |
IUPAC Name | methyl 2-bromoacetate |
InChI Key | YDCHPLOFQATIDS-UHFFFAOYSA-N |
Molecular Formula | C3H5BrO2 |
Isopropyl tetradecanoate, 98%
CAS: 110-27-0 Molecular Formula: C17H34O2 Molecular Weight (g/mol): 270.457 MDL Number: MFCD00008982 InChI Key: AXISYYRBXTVTFY-UHFFFAOYSA-N Synonym: isopropyl myristate,isopropyl tetradecanoate,estergel,bisomel,isomyst,promyr,tetradecanoic acid, 1-methylethyl ester,deltyl extra,kesscomir,tegester PubChem CID: 8042 IUPAC Name: propan-2-yl tetradecanoate SMILES: CCCCCCCCCCCCCC(=O)OC(C)C
PubChem CID | 8042 |
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CAS | 110-27-0 |
Molecular Weight (g/mol) | 270.457 |
MDL Number | MFCD00008982 |
SMILES | CCCCCCCCCCCCCC(=O)OC(C)C |
Synonym | isopropyl myristate,isopropyl tetradecanoate,estergel,bisomel,isomyst,promyr,tetradecanoic acid, 1-methylethyl ester,deltyl extra,kesscomir,tegester |
IUPAC Name | propan-2-yl tetradecanoate |
InChI Key | AXISYYRBXTVTFY-UHFFFAOYSA-N |
Molecular Formula | C17H34O2 |
Propyl gallate, 98%
CAS: 121-79-9 Molecular Formula: C10H12O5 Molecular Weight (g/mol): 212.2 MDL Number: MFCD00002196 InChI Key: ZTHYODDOHIVTJV-UHFFFAOYSA-N Synonym: propyl gallate,n-propyl gallate,progallin p,tenox pg,nipagallin p,gallic acid, propyl ester,gallic acid propyl ester,nipa 49,benzoic acid, 3,4,5-trihydroxy-, propyl ester,3,4,5-trihydroxybenzene-1-propylcarboxylate PubChem CID: 4947 ChEBI: CHEBI:10607 IUPAC Name: propyl 3,4,5-trihydroxybenzoate SMILES: CCCOC(=O)C1=CC(=C(C(=C1)O)O)O
PubChem CID | 4947 |
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CAS | 121-79-9 |
Molecular Weight (g/mol) | 212.2 |
ChEBI | CHEBI:10607 |
MDL Number | MFCD00002196 |
SMILES | CCCOC(=O)C1=CC(=C(C(=C1)O)O)O |
Synonym | propyl gallate,n-propyl gallate,progallin p,tenox pg,nipagallin p,gallic acid, propyl ester,gallic acid propyl ester,nipa 49,benzoic acid, 3,4,5-trihydroxy-, propyl ester,3,4,5-trihydroxybenzene-1-propylcarboxylate |
IUPAC Name | propyl 3,4,5-trihydroxybenzoate |
InChI Key | ZTHYODDOHIVTJV-UHFFFAOYSA-N |
Molecular Formula | C10H12O5 |
Calcium D-gluconate gel, 2.5% w/w aq. soln.
CAS: 299-28-5 Molecular Formula: C12H22CaO14 Molecular Weight (g/mol): 430.372 MDL Number: MFCD00064209 InChI Key: NEEHYRZPVYRGPP-IYEMJOQQSA-L Synonym: calcium gluconate,calcium d-gluconate,calciofon,calglucon,glucobiogen,ebucin,calcicol,calcipur,calglucol,dragocal PubChem CID: 9290 IUPAC Name: calcium;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate SMILES: C(C(C(C(C(C(=O)[O-])O)O)O)O)O.C(C(C(C(C(C(=O)[O-])O)O)O)O)O.[Ca+2]
PubChem CID | 9290 |
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CAS | 299-28-5 |
Molecular Weight (g/mol) | 430.372 |
MDL Number | MFCD00064209 |
SMILES | C(C(C(C(C(C(=O)[O-])O)O)O)O)O.C(C(C(C(C(C(=O)[O-])O)O)O)O)O.[Ca+2] |
Synonym | calcium gluconate,calcium d-gluconate,calciofon,calglucon,glucobiogen,ebucin,calcicol,calcipur,calglucol,dragocal |
IUPAC Name | calcium;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate |
InChI Key | NEEHYRZPVYRGPP-IYEMJOQQSA-L |
Molecular Formula | C12H22CaO14 |
Urea, ultrapure, 99%
CAS: 57-13-6 Molecular Formula: CH4N2O Molecular Weight (g/mol): 60.056 MDL Number: MFCD00008022 InChI Key: XSQUKJJJFZCRTK-UHFFFAOYSA-N Synonym: carbamide,isourea,carbonyldiamide,ureophil,carbonyldiamine,carbamimidic acid,pseudourea,ureaphil,urevert,alphadrate PubChem CID: 1176 ChEBI: CHEBI:48376 IUPAC Name: urea SMILES: C(=O)(N)N
PubChem CID | 1176 |
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CAS | 57-13-6 |
Molecular Weight (g/mol) | 60.056 |
ChEBI | CHEBI:48376 |
MDL Number | MFCD00008022 |
SMILES | C(=O)(N)N |
Synonym | carbamide,isourea,carbonyldiamide,ureophil,carbonyldiamine,carbamimidic acid,pseudourea,ureaphil,urevert,alphadrate |
IUPAC Name | urea |
InChI Key | XSQUKJJJFZCRTK-UHFFFAOYSA-N |
Molecular Formula | CH4N2O |