Organic acids and derivatives
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Thermo Scientific Chemicals Khellin, 95%
CAS: 82-02-0 Molecular Formula: C14H12O5 Molecular Weight (g/mol): 260.25 InChI Key: HSMPDPBYAYSOBC-UHFFFAOYSA-N IUPAC Name: 4,9-dimethoxy-7-methyl-5H-furo[3,2-g]chromen-5-one SMILES: COC1=C2OC=CC2=C(OC)C2=C1OC(C)=CC2=O
| CAS | 82-02-0 |
|---|---|
| Molecular Weight (g/mol) | 260.25 |
| SMILES | COC1=C2OC=CC2=C(OC)C2=C1OC(C)=CC2=O |
| IUPAC Name | 4,9-dimethoxy-7-methyl-5H-furo[3,2-g]chromen-5-one |
| InChI Key | HSMPDPBYAYSOBC-UHFFFAOYSA-N |
| Molecular Formula | C14H12O5 |
Niacinamide, FCC, 98.5-101%, Spectrum™ Chemical
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CAS: 98-92-0 Molecular Formula: C6H6N2O Molecular Weight (g/mol): 122.13 InChI Key: DFPAKSUCGFBDDF-UHFFFAOYSA-N IUPAC Name: pyridine-3-carboxamide SMILES: NC(=O)C1=CC=CN=C1
| CAS | 98-92-0 |
|---|---|
| Molecular Weight (g/mol) | 122.13 |
| SMILES | NC(=O)C1=CC=CN=C1 |
| IUPAC Name | pyridine-3-carboxamide |
| InChI Key | DFPAKSUCGFBDDF-UHFFFAOYSA-N |
| Molecular Formula | C6H6N2O |
Methyl cyclopentanecarboxylate, 97%
CAS: 4630-80-2 Molecular Formula: C7H12O2 Molecular Weight (g/mol): 128.17 MDL Number: MFCD00019290 InChI Key: IIHIJFJSXPDTNO-UHFFFAOYSA-N Synonym: cyclopentanecarboxylic acid, methyl ester,cyclopentanecarboxylic acid methyl ester,methyl cyclopentanoate,acmc-1am5n,methylcyclopentanecarboxylate,methylcyclopentane carboxylate,methyl cyclopentane carboxylate,methyl-1-cyclopentanecarboxylate,cyclopentanoic acid methyl ester,cyclopentanecarboxylic acid methyl PubChem CID: 78365 IUPAC Name: methyl cyclopentanecarboxylate SMILES: COC(=O)C1CCCC1
| PubChem CID | 78365 |
|---|---|
| CAS | 4630-80-2 |
| Molecular Weight (g/mol) | 128.17 |
| MDL Number | MFCD00019290 |
| SMILES | COC(=O)C1CCCC1 |
| Synonym | cyclopentanecarboxylic acid, methyl ester,cyclopentanecarboxylic acid methyl ester,methyl cyclopentanoate,acmc-1am5n,methylcyclopentanecarboxylate,methylcyclopentane carboxylate,methyl cyclopentane carboxylate,methyl-1-cyclopentanecarboxylate,cyclopentanoic acid methyl ester,cyclopentanecarboxylic acid methyl |
| IUPAC Name | methyl cyclopentanecarboxylate |
| InChI Key | IIHIJFJSXPDTNO-UHFFFAOYSA-N |
| Molecular Formula | C7H12O2 |
(+)-Dibenzoyl-D-tartaric acid, 98+%
CAS: 17026-42-5 Molecular Formula: C18H14O8 Molecular Weight (g/mol): 358.30 MDL Number: MFCD00063222 InChI Key: YONLFQNRGZXBBF-ZCWZLOQUNA-N Synonym: dibenzoyl-d-tartaric acid,+-dibenzoyl-d-tartaric acid,2s,3s-2,3-bis benzoyloxy succinic acid,d-dibenzoyl tartaric acid,butanedioic acid, 2,3-bis benzoyloxy-, 2s,3s,+-o,o-dibenzoyltartaric acid,2s,3s-+-dibenzoyltartaric acid,+-dibenzoyltartaric acid,+-dibenzoyl tartaric acid PubChem CID: 1550213 SMILES: OC(=O)[C@@H](OC(=O)C1=CC=CC=C1)[C@H](OC(=O)C1=CC=CC=C1)C(O)=O
| PubChem CID | 1550213 |
|---|---|
| CAS | 17026-42-5 |
| Molecular Weight (g/mol) | 358.30 |
| MDL Number | MFCD00063222 |
| SMILES | OC(=O)[C@@H](OC(=O)C1=CC=CC=C1)[C@H](OC(=O)C1=CC=CC=C1)C(O)=O |
| Synonym | dibenzoyl-d-tartaric acid,+-dibenzoyl-d-tartaric acid,2s,3s-2,3-bis benzoyloxy succinic acid,d-dibenzoyl tartaric acid,butanedioic acid, 2,3-bis benzoyloxy-, 2s,3s,+-o,o-dibenzoyltartaric acid,2s,3s-+-dibenzoyltartaric acid,+-dibenzoyltartaric acid,+-dibenzoyl tartaric acid |
| InChI Key | YONLFQNRGZXBBF-ZCWZLOQUNA-N |
| Molecular Formula | C18H14O8 |
Benzenesulfonic acid isopropyl ester, 95%
CAS: 6214-18-2 Molecular Formula: C9H12O3S Molecular Weight (g/mol): 200.252 MDL Number: MFCD04038771 InChI Key: YQZZXXKFKTWDPY-UHFFFAOYSA-N PubChem CID: 12441430 IUPAC Name: propan-2-yl benzenesulfonate SMILES: CC(C)OS(=O)(=O)C1=CC=CC=C1
| PubChem CID | 12441430 |
|---|---|
| CAS | 6214-18-2 |
| Molecular Weight (g/mol) | 200.252 |
| MDL Number | MFCD04038771 |
| SMILES | CC(C)OS(=O)(=O)C1=CC=CC=C1 |
| IUPAC Name | propan-2-yl benzenesulfonate |
| InChI Key | YQZZXXKFKTWDPY-UHFFFAOYSA-N |
| Molecular Formula | C9H12O3S |
Metanilic acid, 98%
CAS: 121-47-1 Molecular Formula: C6H7NO3S Molecular Weight (g/mol): 173.19 MDL Number: MFCD00065345 InChI Key: ZAJAQTYSTDTMCU-UHFFFAOYSA-N Synonym: metanilic acid,m-sulfanilic acid,m-aminobenzenesulfonic acid,m-anilinesulfonic acid,1-aminobenzene-3-sulfonic acid,benzenesulfonic acid, 3-amino,aminobenzenesulfonic acid,kyselina metanilova,3-amino-benzenesulfonic acid,3-sulfoaniline PubChem CID: 8474 ChEBI: CHEBI:27764 IUPAC Name: 3-aminobenzenesulfonic acid SMILES: C1=CC(=CC(=C1)S(=O)(=O)O)N
| PubChem CID | 8474 |
|---|---|
| CAS | 121-47-1 |
| Molecular Weight (g/mol) | 173.19 |
| ChEBI | CHEBI:27764 |
| MDL Number | MFCD00065345 |
| SMILES | C1=CC(=CC(=C1)S(=O)(=O)O)N |
| Synonym | metanilic acid,m-sulfanilic acid,m-aminobenzenesulfonic acid,m-anilinesulfonic acid,1-aminobenzene-3-sulfonic acid,benzenesulfonic acid, 3-amino,aminobenzenesulfonic acid,kyselina metanilova,3-amino-benzenesulfonic acid,3-sulfoaniline |
| IUPAC Name | 3-aminobenzenesulfonic acid |
| InChI Key | ZAJAQTYSTDTMCU-UHFFFAOYSA-N |
| Molecular Formula | C6H7NO3S |
Ethylenediamine Tetraacetic Acid, ACS, MP Biomedicals™
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 |
|---|---|
| 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 |
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 |
|---|---|
| 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 |
Diethyl (chloromethyl)phosphonate, 98%, Thermo Scientific Chemicals
CAS: 3167-63-3 Molecular Formula: C5H12ClO3P Molecular Weight (g/mol): 186.57 MDL Number: MFCD00010189 InChI Key: MZBIWKMCTWJLPT-UHFFFAOYSA-N Synonym: diethyl chloromethyl phosphonate,diethyl chloromethylphosphonate,diethyl chloromethanephosphonate,phosphonic acid, chloromethyl-, diethyl ester,chloromethylphosphonic acid diethyl ester,phosphonic acid, p-chloromethyl-, diethyl ester,chloromethyl phosphonic acid diethyl ester,1-chloromethyl ethoxy phosphoryl oxyethane,acmc-1cq3s PubChem CID: 76633 IUPAC Name: 1-[chloromethyl(ethoxy)phosphoryl]oxyethane SMILES: CCOP(=O)(CCl)OCC
| PubChem CID | 76633 |
|---|---|
| CAS | 3167-63-3 |
| Molecular Weight (g/mol) | 186.57 |
| MDL Number | MFCD00010189 |
| SMILES | CCOP(=O)(CCl)OCC |
| Synonym | diethyl chloromethyl phosphonate,diethyl chloromethylphosphonate,diethyl chloromethanephosphonate,phosphonic acid, chloromethyl-, diethyl ester,chloromethylphosphonic acid diethyl ester,phosphonic acid, p-chloromethyl-, diethyl ester,chloromethyl phosphonic acid diethyl ester,1-chloromethyl ethoxy phosphoryl oxyethane,acmc-1cq3s |
| IUPAC Name | 1-[chloromethyl(ethoxy)phosphoryl]oxyethane |
| InChI Key | MZBIWKMCTWJLPT-UHFFFAOYSA-N |
| Molecular Formula | C5H12ClO3P |
Triethylsilyl trifluoromethanesulfonate, 99%
CAS: 79271-56-0 Molecular Formula: C7H15F3O3SSi Molecular Weight (g/mol): 264.33 MDL Number: MFCD00000407 InChI Key: STMPXDBGVJZCEX-UHFFFAOYSA-N Synonym: triethylsilyl triflate,triethylsilyl trifluoromethanesulphonate,tes triflate,triethylsilyltriflate,triethylsilyltrifluoromethanesulfonate,trifluoromethanesulfonic acid triethylsilyl ester,1,1,1-triethylsilyl trifluoromethanesulfonate,methanesulfonic acid, trifluoro-, triethylsilyl ester,et3siotf,tesotf PubChem CID: 2733308 IUPAC Name: triethylsilyl trifluoromethanesulfonate SMILES: CC[Si](CC)(CC)OS(=O)(=O)C(F)(F)F
| PubChem CID | 2733308 |
|---|---|
| CAS | 79271-56-0 |
| Molecular Weight (g/mol) | 264.33 |
| MDL Number | MFCD00000407 |
| SMILES | CC[Si](CC)(CC)OS(=O)(=O)C(F)(F)F |
| Synonym | triethylsilyl triflate,triethylsilyl trifluoromethanesulphonate,tes triflate,triethylsilyltriflate,triethylsilyltrifluoromethanesulfonate,trifluoromethanesulfonic acid triethylsilyl ester,1,1,1-triethylsilyl trifluoromethanesulfonate,methanesulfonic acid, trifluoro-, triethylsilyl ester,et3siotf,tesotf |
| IUPAC Name | triethylsilyl trifluoromethanesulfonate |
| InChI Key | STMPXDBGVJZCEX-UHFFFAOYSA-N |
| Molecular Formula | C7H15F3O3SSi |
Phenazine methosulfate, 98+%
CAS: 299-11-6 Molecular Formula: C14H14N2O4S Molecular Weight (g/mol): 306.336 MDL Number: MFCD00011923 InChI Key: RXGJTUSBYWCRBK-UHFFFAOYSA-M Synonym: phenazine methosulfate,5-methylphenazin-5-ium methyl sulfate,5-methylphenazinium methyl sulfate,n-methylphenazonium methosulfate,phenazine methosulphate,methylphenazonium methosulfate,5-methylphenazine methylsulfate,n-methylphenazinium methosulfate,n-methylphenazonium methosulphate,phenazinium, 5-methyl-, methyl sulfate PubChem CID: 9285 ChEBI: CHEBI:8055 IUPAC Name: 5-methylphenazin-5-ium;methyl sulfate SMILES: C[N+]1=C2C=CC=CC2=NC3=CC=CC=C31.COS(=O)(=O)[O-]
| PubChem CID | 9285 |
|---|---|
| CAS | 299-11-6 |
| Molecular Weight (g/mol) | 306.336 |
| ChEBI | CHEBI:8055 |
| MDL Number | MFCD00011923 |
| SMILES | C[N+]1=C2C=CC=CC2=NC3=CC=CC=C31.COS(=O)(=O)[O-] |
| Synonym | phenazine methosulfate,5-methylphenazin-5-ium methyl sulfate,5-methylphenazinium methyl sulfate,n-methylphenazonium methosulfate,phenazine methosulphate,methylphenazonium methosulfate,5-methylphenazine methylsulfate,n-methylphenazinium methosulfate,n-methylphenazonium methosulphate,phenazinium, 5-methyl-, methyl sulfate |
| IUPAC Name | 5-methylphenazin-5-ium;methyl sulfate |
| InChI Key | RXGJTUSBYWCRBK-UHFFFAOYSA-M |
| Molecular Formula | C14H14N2O4S |
Copper(II) trifluoromethanesulfonate, 98%
CAS: 34946-82-2 Molecular Formula: CHCuF3O3S Molecular Weight (g/mol): 213.617 MDL Number: MFCD00077492 InChI Key: GZWXEFRPSWBAGC-UHFFFAOYSA-N Synonym: copper; trifluoromethanesulfonic acid PubChem CID: 45051791 IUPAC Name: copper;trifluoromethanesulfonic acid SMILES: C(F)(F)(F)S(=O)(=O)O.[Cu]
| PubChem CID | 45051791 |
|---|---|
| CAS | 34946-82-2 |
| Molecular Weight (g/mol) | 213.617 |
| MDL Number | MFCD00077492 |
| SMILES | C(F)(F)(F)S(=O)(=O)O.[Cu] |
| Synonym | copper; trifluoromethanesulfonic acid |
| IUPAC Name | copper;trifluoromethanesulfonic acid |
| InChI Key | GZWXEFRPSWBAGC-UHFFFAOYSA-N |
| Molecular Formula | CHCuF3O3S |
Naproxen Sodium, USP, 98-102%, Spectrum™ Chemical
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CAS: 26159-34-2 Molecular Formula: C14H13NaO3 Molecular Weight (g/mol): 252.25 MDL Number: MFCD00058507 InChI Key: CDBRNDSHEYLDJV-FVGYRXGTSA-M IUPAC Name: sodium (2S)-2-(6-methoxynaphthalen-2-yl)propanoate SMILES: [Na+].COC1=CC=C2C=C(C=CC2=C1)[C@H](C)C([O-])=O
| CAS | 26159-34-2 |
|---|---|
| Molecular Weight (g/mol) | 252.25 |
| MDL Number | MFCD00058507 |
| SMILES | [Na+].COC1=CC=C2C=C(C=CC2=C1)[C@H](C)C([O-])=O |
| IUPAC Name | sodium (2S)-2-(6-methoxynaphthalen-2-yl)propanoate |
| InChI Key | CDBRNDSHEYLDJV-FVGYRXGTSA-M |
| Molecular Formula | C14H13NaO3 |
Methyl (R)-(+)-lactate, 98%
CAS: 17392-83-5 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.11 MDL Number: MFCD00004517 InChI Key: LPEKGGXMPWTOCB-UHFFFAOYNA-N Synonym: methyl r-+-lactate,methyl d-lactate,r-methyl 2-hydroxypropanoate,methyl r-lactate,+-methyl d-lactate,methyl 2r-2-hydroxypropanoate,d-lactic acid methyl ester,methyl lactate, +,unii-45mz1t3tbv,r-methyl lactate PubChem CID: 637514 ChEBI: CHEBI:74611 SMILES: COC(=O)C(C)O
| PubChem CID | 637514 |
|---|---|
| CAS | 17392-83-5 |
| Molecular Weight (g/mol) | 104.11 |
| ChEBI | CHEBI:74611 |
| MDL Number | MFCD00004517 |
| SMILES | COC(=O)C(C)O |
| Synonym | methyl r-+-lactate,methyl d-lactate,r-methyl 2-hydroxypropanoate,methyl r-lactate,+-methyl d-lactate,methyl 2r-2-hydroxypropanoate,d-lactic acid methyl ester,methyl lactate, +,unii-45mz1t3tbv,r-methyl lactate |
| InChI Key | LPEKGGXMPWTOCB-UHFFFAOYNA-N |
| Molecular Formula | C4H8O3 |
Methyl 3,3-dimethoxypropionate, 99%
CAS: 7424-91-1 Molecular Formula: C6H12O4 Molecular Weight (g/mol): 148.16 MDL Number: MFCD00010650 InChI Key: SMCVPMKCDDNUCQ-UHFFFAOYSA-N Synonym: methyl 3,3-dimethoxypropionate,3,3-dimethoxypropionic acid methyl ester,methyl3,3-dimethoxypropionate,propanoic acid, 3,3-dimethoxy-, methyl ester,zlchem 282,pubchem20228,acmc-1bdjk,ksc490c4j,methyl 3,3-dimethoxy-propanoate,smcvpmkcddnucq-uhfffaoysa PubChem CID: 81924 IUPAC Name: methyl 3,3-dimethoxypropanoate SMILES: COC(CC(=O)OC)OC
| PubChem CID | 81924 |
|---|---|
| CAS | 7424-91-1 |
| Molecular Weight (g/mol) | 148.16 |
| MDL Number | MFCD00010650 |
| SMILES | COC(CC(=O)OC)OC |
| Synonym | methyl 3,3-dimethoxypropionate,3,3-dimethoxypropionic acid methyl ester,methyl3,3-dimethoxypropionate,propanoic acid, 3,3-dimethoxy-, methyl ester,zlchem 282,pubchem20228,acmc-1bdjk,ksc490c4j,methyl 3,3-dimethoxy-propanoate,smcvpmkcddnucq-uhfffaoysa |
| IUPAC Name | methyl 3,3-dimethoxypropanoate |
| InChI Key | SMCVPMKCDDNUCQ-UHFFFAOYSA-N |
| Molecular Formula | C6H12O4 |