Organic acids and derivatives
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Thermo Scientific Chemicals Trifluoromethanesulfonic acid, 98+%
CAS: 1493-13-6 Molecular Formula: CHF3O3S Molecular Weight (g/mol): 150.07 MDL Number: MFCD00007514 InChI Key: ITMCEJHCFYSIIV-UHFFFAOYSA-N Synonym: triflic acid,perfluoromethanesulfonic acid,trifluoromethanesulphonic acid,tfmsa,trifluoromethane sulfonic acid,tfoh,methanesulfonic acid, trifluoro,hotf,trifluoromethylsulfonic acid,trimsylate PubChem CID: 62406 ChEBI: CHEBI:48511 IUPAC Name: trifluoromethanesulfonic acid SMILES: OS(=O)(=O)C(F)(F)F
| PubChem CID | 62406 |
|---|---|
| CAS | 1493-13-6 |
| Molecular Weight (g/mol) | 150.07 |
| ChEBI | CHEBI:48511 |
| MDL Number | MFCD00007514 |
| SMILES | OS(=O)(=O)C(F)(F)F |
| Synonym | triflic acid,perfluoromethanesulfonic acid,trifluoromethanesulphonic acid,tfmsa,trifluoromethane sulfonic acid,tfoh,methanesulfonic acid, trifluoro,hotf,trifluoromethylsulfonic acid,trimsylate |
| IUPAC Name | trifluoromethanesulfonic acid |
| InChI Key | ITMCEJHCFYSIIV-UHFFFAOYSA-N |
| Molecular Formula | CHF3O3S |
1,3-Propanesultone 99.0+%, TCI America™
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CAS: 1120-71-4 Molecular Formula: C3H6O3S Molecular Weight (g/mol): 122.14 MDL Number: MFCD00005355 InChI Key: FSSPGSAQUIYDCN-UHFFFAOYSA-N Synonym: 1,3-propanesultone,propane sultone,1,2-oxathiolane 2,2-dioxide,1,3-propane sultone,1,2-oxathiolane, 2,2-dioxide,propanesultone,rcra waste number u193,.gamma.-propane sultone,3-hydroxy-1-propanesulfonic acid gamma-sultone,unii-l6ntk7vjx9 PubChem CID: 14264 ChEBI: CHEBI:82370 IUPAC Name: 1,2λ⁶-oxathiolane-2,2-dione SMILES: O=S1(=O)CCCO1
| PubChem CID | 14264 |
|---|---|
| CAS | 1120-71-4 |
| Molecular Weight (g/mol) | 122.14 |
| ChEBI | CHEBI:82370 |
| MDL Number | MFCD00005355 |
| SMILES | O=S1(=O)CCCO1 |
| Synonym | 1,3-propanesultone,propane sultone,1,2-oxathiolane 2,2-dioxide,1,3-propane sultone,1,2-oxathiolane, 2,2-dioxide,propanesultone,rcra waste number u193,.gamma.-propane sultone,3-hydroxy-1-propanesulfonic acid gamma-sultone,unii-l6ntk7vjx9 |
| IUPAC Name | 1,2λ⁶-oxathiolane-2,2-dione |
| InChI Key | FSSPGSAQUIYDCN-UHFFFAOYSA-N |
| Molecular Formula | C3H6O3S |
Trifluoromethanesulfonic Anhydride 98.0+%, TCI America™
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CAS: 358-23-6 Molecular Formula: C2F6O5S2 Molecular Weight (g/mol): 282.127 MDL Number: MFCD00000408 InChI Key: WJKHJLXJJJATHN-UHFFFAOYSA-N Synonym: trifluoromethanesulfonic anhydride,triflic anhydride,trifluoromethanesulphonic anhydride,trifluoromethanesulfonic acid anhydride,methanesulfonic acid, trifluoro-, anhydride,trifluoromethanesulphonic acid anhydride,unii-8w034lhg1u,tf2o,trifluoromethane sulfonyl trifluoromethanesulfonate,trifluoromethane sulfonic anhydride PubChem CID: 67749 ChEBI: CHEBI:48509 IUPAC Name: trifluoromethylsulfonyl trifluoromethanesulfonate SMILES: C(F)(F)(F)S(=O)(=O)OS(=O)(=O)C(F)(F)F
| PubChem CID | 67749 |
|---|---|
| CAS | 358-23-6 |
| Molecular Weight (g/mol) | 282.127 |
| ChEBI | CHEBI:48509 |
| MDL Number | MFCD00000408 |
| SMILES | C(F)(F)(F)S(=O)(=O)OS(=O)(=O)C(F)(F)F |
| Synonym | trifluoromethanesulfonic anhydride,triflic anhydride,trifluoromethanesulphonic anhydride,trifluoromethanesulfonic acid anhydride,methanesulfonic acid, trifluoro-, anhydride,trifluoromethanesulphonic acid anhydride,unii-8w034lhg1u,tf2o,trifluoromethane sulfonyl trifluoromethanesulfonate,trifluoromethane sulfonic anhydride |
| IUPAC Name | trifluoromethylsulfonyl trifluoromethanesulfonate |
| InChI Key | WJKHJLXJJJATHN-UHFFFAOYSA-N |
| Molecular Formula | C2F6O5S2 |
Trifluoromethanesulfonic Acid 98.0+%, TCI America™
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CAS: 1493-13-6 Molecular Formula: CHF3O3S Molecular Weight (g/mol): 150.07 MDL Number: MFCD00007514 InChI Key: ITMCEJHCFYSIIV-UHFFFAOYSA-N Synonym: triflic acid,perfluoromethanesulfonic acid,trifluoromethanesulphonic acid,tfmsa,trifluoromethane sulfonic acid,tfoh,methanesulfonic acid, trifluoro,hotf,trifluoromethylsulfonic acid,trimsylate PubChem CID: 62406 ChEBI: CHEBI:48511 IUPAC Name: trifluoromethanesulfonic acid SMILES: OS(=O)(=O)C(F)(F)F
| PubChem CID | 62406 |
|---|---|
| CAS | 1493-13-6 |
| Molecular Weight (g/mol) | 150.07 |
| ChEBI | CHEBI:48511 |
| MDL Number | MFCD00007514 |
| SMILES | OS(=O)(=O)C(F)(F)F |
| Synonym | triflic acid,perfluoromethanesulfonic acid,trifluoromethanesulphonic acid,tfmsa,trifluoromethane sulfonic acid,tfoh,methanesulfonic acid, trifluoro,hotf,trifluoromethylsulfonic acid,trimsylate |
| IUPAC Name | trifluoromethanesulfonic acid |
| InChI Key | ITMCEJHCFYSIIV-UHFFFAOYSA-N |
| Molecular Formula | CHF3O3S |
Propionic Acid 99.0+%, TCI America™
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CAS: 79-09-4 Molecular Formula: C3H6O2 Molecular Weight (g/mol): 74.079 MDL Number: MFCD00002756 InChI Key: XBDQKXXYIPTUBI-UHFFFAOYSA-N Synonym: propionic acid,ethylformic acid,methylacetic acid,carboxyethane,ethanecarboxylic acid,pseudoacetic acid,metacetonic acid,monoprop,luprosil,prozoin PubChem CID: 1032 ChEBI: CHEBI:30768 IUPAC Name: propanoic acid SMILES: CCC(=O)O
| PubChem CID | 1032 |
|---|---|
| CAS | 79-09-4 |
| Molecular Weight (g/mol) | 74.079 |
| ChEBI | CHEBI:30768 |
| MDL Number | MFCD00002756 |
| SMILES | CCC(=O)O |
| Synonym | propionic acid,ethylformic acid,methylacetic acid,carboxyethane,ethanecarboxylic acid,pseudoacetic acid,metacetonic acid,monoprop,luprosil,prozoin |
| IUPAC Name | propanoic acid |
| InChI Key | XBDQKXXYIPTUBI-UHFFFAOYSA-N |
| Molecular Formula | C3H6O2 |
Thermo Scientific Chemicals Trimethyl 1,3,5-benzenetricarboxylate, 99%
CAS: 2672-58-4 Molecular Formula: C12H12O6 Molecular Weight (g/mol): 252.22 MDL Number: MFCD00008434 InChI Key: RGCHNYAILFZUPL-UHFFFAOYSA-N Synonym: trimethyl 1,3,5-benzenetricarboxylate,trimethyl trimesate,trimesic acid trimethyl ester,1,3,5-benzenetricarboxylic acid, trimethyl ester,1,3,5-benzenetricarboxylic acid trimethyl ester,trimethylbenzene-1,3,5-tricarboxylate,1,3,5-trimethyl benzene-1,3,5-tricarboxylate,methyl 3,5-bis methoxycarbonyl benzoate,benzene-1,3,5-tricarboxylic acid trimethyl ester,timtec-bb sbb007766 PubChem CID: 75881 IUPAC Name: trimethyl benzene-1,3,5-tricarboxylate SMILES: COC(=O)C1=CC(=CC(=C1)C(=O)OC)C(=O)OC
| PubChem CID | 75881 |
|---|---|
| CAS | 2672-58-4 |
| Molecular Weight (g/mol) | 252.22 |
| MDL Number | MFCD00008434 |
| SMILES | COC(=O)C1=CC(=CC(=C1)C(=O)OC)C(=O)OC |
| Synonym | trimethyl 1,3,5-benzenetricarboxylate,trimethyl trimesate,trimesic acid trimethyl ester,1,3,5-benzenetricarboxylic acid, trimethyl ester,1,3,5-benzenetricarboxylic acid trimethyl ester,trimethylbenzene-1,3,5-tricarboxylate,1,3,5-trimethyl benzene-1,3,5-tricarboxylate,methyl 3,5-bis methoxycarbonyl benzoate,benzene-1,3,5-tricarboxylic acid trimethyl ester,timtec-bb sbb007766 |
| IUPAC Name | trimethyl benzene-1,3,5-tricarboxylate |
| InChI Key | RGCHNYAILFZUPL-UHFFFAOYSA-N |
| Molecular Formula | C12H12O6 |
Thermo Scientific Chemicals Methyl 6-chloropyridazine-4-carboxylate, 97%
CAS: 1093860-48-0 Molecular Formula: C6H5ClN2O2 Molecular Weight (g/mol): 172.57 MDL Number: MFCD16660968 InChI Key: QYQHGLKSLGUINZ-UHFFFAOYSA-N Synonym: 6-chloro-pyridazine-4-carboxylic acid methyl ester,methyl6-chloropyridazine-4-carboxylate,4-pyridazinecarboxylicacid, 6-chloro-, methyl ester,6-chloro-4-pyridazinecarboxylic acid, methyl ester,4-pyridazinecarboxylic acid, 6-chloro-, methyl ester PubChem CID: 45790080 IUPAC Name: methyl 6-chloropyridazine-4-carboxylate SMILES: COC(=O)C1=CC(Cl)=NN=C1
| PubChem CID | 45790080 |
|---|---|
| CAS | 1093860-48-0 |
| Molecular Weight (g/mol) | 172.57 |
| MDL Number | MFCD16660968 |
| SMILES | COC(=O)C1=CC(Cl)=NN=C1 |
| Synonym | 6-chloro-pyridazine-4-carboxylic acid methyl ester,methyl6-chloropyridazine-4-carboxylate,4-pyridazinecarboxylicacid, 6-chloro-, methyl ester,6-chloro-4-pyridazinecarboxylic acid, methyl ester,4-pyridazinecarboxylic acid, 6-chloro-, methyl ester |
| IUPAC Name | methyl 6-chloropyridazine-4-carboxylate |
| InChI Key | QYQHGLKSLGUINZ-UHFFFAOYSA-N |
| Molecular Formula | C6H5ClN2O2 |
MilliporeSigma Supelco LiChropur™ Ammonium formate, Eluent additive for LC-MS, ≥99.0%, MilliporeSigma™ Supelco™
MDL Number: MFCD00013103 Synonym: Formic acid ammonium salt
| MDL Number | MFCD00013103 |
|---|---|
| Synonym | Formic acid ammonium salt |
Thermo Scientific Chemicals Methyl 3-bromopropionate, 97%
CAS: 3395-91-3 Molecular Formula: C4H7BrO2 Molecular Weight (g/mol): 167.00 MDL Number: MFCD00000250 InChI Key: KQEVIFKPZOGBMZ-UHFFFAOYSA-N Synonym: methyl 3-bromopropionate,propanoic acid, 3-bromo-, methyl ester,methyl beta-bromopropionate,3-bromopropionic acid methyl ester,propionic acid, 3-bromo-, methyl ester,3-bromopropanoic acid methyl ester,unii-y803ch1p4w,beta-bromopropionic acid, methyl ester,methyl .beta.-bromopropionate,3-bromo-propionic acid methyl ester PubChem CID: 76934 IUPAC Name: methyl 3-bromopropanoate SMILES: COC(=O)CCBr
| PubChem CID | 76934 |
|---|---|
| CAS | 3395-91-3 |
| Molecular Weight (g/mol) | 167.00 |
| MDL Number | MFCD00000250 |
| SMILES | COC(=O)CCBr |
| Synonym | methyl 3-bromopropionate,propanoic acid, 3-bromo-, methyl ester,methyl beta-bromopropionate,3-bromopropionic acid methyl ester,propionic acid, 3-bromo-, methyl ester,3-bromopropanoic acid methyl ester,unii-y803ch1p4w,beta-bromopropionic acid, methyl ester,methyl .beta.-bromopropionate,3-bromo-propionic acid methyl ester |
| IUPAC Name | methyl 3-bromopropanoate |
| InChI Key | KQEVIFKPZOGBMZ-UHFFFAOYSA-N |
| Molecular Formula | C4H7BrO2 |
Thermo Scientific Chemicals Methyl cyanoacetate, 97%
CAS: 105-34-0 Molecular Formula: C4H5NO2 Molecular Weight (g/mol): 99.09 MDL Number: MFCD00001939 InChI Key: ANGDWNBGPBMQHW-UHFFFAOYSA-N Synonym: methyl cyanoacetate,cyanoacetic acid methyl ester,methyl cyanoethanoate,acetic acid, cyano-, methyl ester,usaf kf-22,methylester kyseliny kyanoctove,methylcyanoacetate,malonic methyl ester nitrile,acetic acid, 2-cyano-, methyl ester,methyl cyano acetate PubChem CID: 7747 ChEBI: CHEBI:51928 IUPAC Name: methyl 2-cyanoacetate SMILES: COC(=O)CC#N
| PubChem CID | 7747 |
|---|---|
| CAS | 105-34-0 |
| Molecular Weight (g/mol) | 99.09 |
| ChEBI | CHEBI:51928 |
| MDL Number | MFCD00001939 |
| SMILES | COC(=O)CC#N |
| Synonym | methyl cyanoacetate,cyanoacetic acid methyl ester,methyl cyanoethanoate,acetic acid, cyano-, methyl ester,usaf kf-22,methylester kyseliny kyanoctove,methylcyanoacetate,malonic methyl ester nitrile,acetic acid, 2-cyano-, methyl ester,methyl cyano acetate |
| IUPAC Name | methyl 2-cyanoacetate |
| InChI Key | ANGDWNBGPBMQHW-UHFFFAOYSA-N |
| Molecular Formula | C4H5NO2 |
Thermo Scientific Chemicals N-(4-Pentynyl)phthalimide, 97%
CAS: 6097-07-0 Molecular Formula: C13H11NO2 Molecular Weight (g/mol): 213.23 MDL Number: MFCD06798110 InChI Key: YNZIPXLLPFYDGM-UHFFFAOYSA-N Synonym: n-4-pentynyl phthalimide,2-pent-4-ynyl isoindoline-1,3-dione,1-phthalimido-4-pentyne,2-pent-4-yn-1-yl isoindoline-1,3-dione,n-4-pentynyl phthalimide 97,2-pent-4-yn-1-yl isoindole-1,3-dione,5-phthalimido-1-pentyne,2-pent-4-ynyl-isoindole-1,3-dione PubChem CID: 11769822 IUPAC Name: 2-pent-4-ynylisoindole-1,3-dione SMILES: C#CCCCN1C(=O)C2=CC=CC=C2C1=O
| PubChem CID | 11769822 |
|---|---|
| CAS | 6097-07-0 |
| Molecular Weight (g/mol) | 213.23 |
| MDL Number | MFCD06798110 |
| SMILES | C#CCCCN1C(=O)C2=CC=CC=C2C1=O |
| Synonym | n-4-pentynyl phthalimide,2-pent-4-ynyl isoindoline-1,3-dione,1-phthalimido-4-pentyne,2-pent-4-yn-1-yl isoindoline-1,3-dione,n-4-pentynyl phthalimide 97,2-pent-4-yn-1-yl isoindole-1,3-dione,5-phthalimido-1-pentyne,2-pent-4-ynyl-isoindole-1,3-dione |
| IUPAC Name | 2-pent-4-ynylisoindole-1,3-dione |
| InChI Key | YNZIPXLLPFYDGM-UHFFFAOYSA-N |
| Molecular Formula | C13H11NO2 |
Thermo Scientific Chemicals Propyl p-toluenesulfonate, 98+%
CAS: 599-91-7 Molecular Formula: C10H14O3S Molecular Weight (g/mol): 214.28 MDL Number: MFCD00059244 InChI Key: JTTWNTXHFYNETH-UHFFFAOYSA-N Synonym: propyl p-toluenesulfonate,propyl tosylate,benzenesulfonic acid, 4-methyl-, propyl ester,p-toluenesulfonic acid, propyl ester,propyl toluene-4-sulphonate,ccris 9150,p-toluenesulfonic acid n-propyl ester,p-toluenesulfonic acid propyl ester,propanol tosylate,acmc-209mha PubChem CID: 69035 IUPAC Name: propyl 4-methylbenzenesulfonate SMILES: CCCOS(=O)(=O)C1=CC=C(C=C1)C
| PubChem CID | 69035 |
|---|---|
| CAS | 599-91-7 |
| Molecular Weight (g/mol) | 214.28 |
| MDL Number | MFCD00059244 |
| SMILES | CCCOS(=O)(=O)C1=CC=C(C=C1)C |
| Synonym | propyl p-toluenesulfonate,propyl tosylate,benzenesulfonic acid, 4-methyl-, propyl ester,p-toluenesulfonic acid, propyl ester,propyl toluene-4-sulphonate,ccris 9150,p-toluenesulfonic acid n-propyl ester,p-toluenesulfonic acid propyl ester,propanol tosylate,acmc-209mha |
| IUPAC Name | propyl 4-methylbenzenesulfonate |
| InChI Key | JTTWNTXHFYNETH-UHFFFAOYSA-N |
| Molecular Formula | C10H14O3S |
Avantor J.T.Baker EDTA Disodium Salt, Dihydrate, BAKER ANALYZED™ A.C.S. Reagent, J.T. Baker™
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 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 |
| InChI Key | OVBJJZOQPCKUOR-UHFFFAOYSA-L |
| Molecular Formula | C10H18N2Na2O10 |
Thermo Scientific Chemicals Dimethyl maleate, 96%
CAS: 624-48-6 Molecular Formula: C6H8O4 Molecular Weight (g/mol): 144.13 MDL Number: MFCD00008459 InChI Key: LDCRTTXIJACKKU-ARJAWSKDSA-N Synonym: dimethyl maleate,maleic acid, dimethyl ester,methyl maleate,sipomer dmm,maleic acid dimethyl ester,dimethyl cis-butenedioate,2-butenedioic acid z-, dimethyl ester,dimethyl cis-ethylenedicarboxylate,2-butenedioic acid 2z-, dimethyl ester,2-butenedioic acid, dimethyl ester, z PubChem CID: 5271565 ChEBI: CHEBI:35460 IUPAC Name: dimethyl (Z)-but-2-enedioate SMILES: COC(=O)C=CC(=O)OC
| PubChem CID | 5271565 |
|---|---|
| CAS | 624-48-6 |
| Molecular Weight (g/mol) | 144.13 |
| ChEBI | CHEBI:35460 |
| MDL Number | MFCD00008459 |
| SMILES | COC(=O)C=CC(=O)OC |
| Synonym | dimethyl maleate,maleic acid, dimethyl ester,methyl maleate,sipomer dmm,maleic acid dimethyl ester,dimethyl cis-butenedioate,2-butenedioic acid z-, dimethyl ester,dimethyl cis-ethylenedicarboxylate,2-butenedioic acid 2z-, dimethyl ester,2-butenedioic acid, dimethyl ester, z |
| IUPAC Name | dimethyl (Z)-but-2-enedioate |
| InChI Key | LDCRTTXIJACKKU-ARJAWSKDSA-N |
| Molecular Formula | C6H8O4 |
Thermo Scientific Chemicals 5-Indolylboronic acid, 97%
CAS: 144104-59-6 Molecular Formula: C8H8BNO2 Molecular Weight (g/mol): 160.97 MDL Number: MFCD01319013 InChI Key: VHADYSUJZAPXOW-UHFFFAOYSA-N Synonym: 5-indolylboronic acid,indole-5-boronic acid,1h-indol-5-yl boronic acid,1h-indole-5-boronic acid,5-indolboronic acid,5-indolyl boronic acid,5-indole-boronic acid,1h-indol-5-ylboranediol,5-indole boric acid,5-indoleboronic acid PubChem CID: 2734361 IUPAC Name: 1H-indol-5-ylboronic acid SMILES: OB(O)C1=CC=C2NC=CC2=C1
| PubChem CID | 2734361 |
|---|---|
| CAS | 144104-59-6 |
| Molecular Weight (g/mol) | 160.97 |
| MDL Number | MFCD01319013 |
| SMILES | OB(O)C1=CC=C2NC=CC2=C1 |
| Synonym | 5-indolylboronic acid,indole-5-boronic acid,1h-indol-5-yl boronic acid,1h-indole-5-boronic acid,5-indolboronic acid,5-indolyl boronic acid,5-indole-boronic acid,1h-indol-5-ylboranediol,5-indole boric acid,5-indoleboronic acid |
| IUPAC Name | 1H-indol-5-ylboronic acid |
| InChI Key | VHADYSUJZAPXOW-UHFFFAOYSA-N |
| Molecular Formula | C8H8BNO2 |