Organic acids and derivatives
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1,3-Dimethyl-3,4,5,6-tetrahydro-2(1H)-pyrimidinone, 97%, pure
CAS: 7226-23-5 Molecular Formula: C6H12N2O Molecular Weight (g/mol): 128.17 MDL Number: MFCD00006550 InChI Key: GUVUOGQBMYCBQP-UHFFFAOYSA-N Synonym: 1,3-dimethyl-3,4,5,6-tetrahydro-2 1h-pyrimidinone,1,3-dimethyltetrahydropyrimidin-2 1h-one,dmpu,dimethylpropyleneurea,2 1h-pyrimidinone, tetrahydro-1,3-dimethyl,n,n'-dimethylpropyleneurea,n,n'-dimethyltrimethyleneurea,ccris 4322,n,n'-dimethylpropylene urea,tetrahydro-1,3-dimethyl-2 1h pyrimidine PubChem CID: 81646 IUPAC Name: 1,3-dimethyl-1,3-diazinan-2-one SMILES: CN1CCCN(C1=O)C
| PubChem CID | 81646 |
|---|---|
| CAS | 7226-23-5 |
| Molecular Weight (g/mol) | 128.17 |
| MDL Number | MFCD00006550 |
| SMILES | CN1CCCN(C1=O)C |
| Synonym | 1,3-dimethyl-3,4,5,6-tetrahydro-2 1h-pyrimidinone,1,3-dimethyltetrahydropyrimidin-2 1h-one,dmpu,dimethylpropyleneurea,2 1h-pyrimidinone, tetrahydro-1,3-dimethyl,n,n'-dimethylpropyleneurea,n,n'-dimethyltrimethyleneurea,ccris 4322,n,n'-dimethylpropylene urea,tetrahydro-1,3-dimethyl-2 1h pyrimidine |
| IUPAC Name | 1,3-dimethyl-1,3-diazinan-2-one |
| InChI Key | GUVUOGQBMYCBQP-UHFFFAOYSA-N |
| Molecular Formula | C6H12N2O |
Calcium propionate, 98+%
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 |
|---|---|
| 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 |
n-Butyl acetate, Semiconductor Grade, 99% min
CAS: 123-86-4 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00009445 InChI Key: DKPFZGUDAPQIHT-UHFFFAOYSA-N Synonym: n-butyl acetate,acetic acid, butyl ester,1-butyl acetate,butyl ethanoate,acetic acid butyl ester,n-butyl ethanoate,n-butylacetate,butylacetat,acetic acid n-butyl ester,acetate de butyle PubChem CID: 31272 ChEBI: CHEBI:31328 IUPAC Name: butyl acetate SMILES: CCCCOC(C)=O
| PubChem CID | 31272 |
|---|---|
| CAS | 123-86-4 |
| Molecular Weight (g/mol) | 116.16 |
| ChEBI | CHEBI:31328 |
| MDL Number | MFCD00009445 |
| SMILES | CCCCOC(C)=O |
| Synonym | n-butyl acetate,acetic acid, butyl ester,1-butyl acetate,butyl ethanoate,acetic acid butyl ester,n-butyl ethanoate,n-butylacetate,butylacetat,acetic acid n-butyl ester,acetate de butyle |
| IUPAC Name | butyl acetate |
| InChI Key | DKPFZGUDAPQIHT-UHFFFAOYSA-N |
| Molecular Formula | C6H12O2 |
Citric acid monohydrate, 99+%, ACS reagent
CAS: 5949-29-1 Molecular Formula: C6H8O7·H2O Molecular Weight (g/mol): 210.15 InChI Key: YASYEJJMZJALEJ-UHFFFAOYSA-N Synonym: citric acid monohydrate,citric acid hydrate,2-hydroxypropane-1,2,3-tricarboxylic acid hydrate,citric acid, monohydrate,unii-2968phw8qp,1,2,3-propanetricarboxylic acid, 2-hydroxy-, monohydrate,citrate,acidum citricum monohydricum,citric acid monohydrate usp PubChem CID: 22230 ChEBI: CHEBI:31404 IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate SMILES: C(C(=O)O)C(CC(=O)O)(C(=O)O)O.O
| PubChem CID | 22230 |
|---|---|
| CAS | 5949-29-1 |
| Molecular Weight (g/mol) | 210.15 |
| ChEBI | CHEBI:31404 |
| SMILES | C(C(=O)O)C(CC(=O)O)(C(=O)O)O.O |
| Synonym | citric acid monohydrate,citric acid hydrate,2-hydroxypropane-1,2,3-tricarboxylic acid hydrate,citric acid, monohydrate,unii-2968phw8qp,1,2,3-propanetricarboxylic acid, 2-hydroxy-, monohydrate,citrate,acidum citricum monohydricum,citric acid monohydrate usp |
| IUPAC Name | 2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate |
| InChI Key | YASYEJJMZJALEJ-UHFFFAOYSA-N |
| Molecular Formula | C6H8O7·H2O |
Methyl methacrylate, 99%, stab.
CAS: 80-62-6 Molecular Formula: C5H8O2 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
| PubChem CID | 6658 |
|---|---|
| CAS | 80-62-6 |
| ChEBI | CHEBI:34840 |
| MDL Number | MFCD00008587 |
| 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 |
2-Propylpentanoic acid, 99%
CAS: 99-66-1 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.21 MDL Number: MFCD00002672 InChI Key: NIJJYAXOARWZEE-UHFFFAOYSA-N Synonym: valproic acid,dipropylacetic acid,depakene,depakine,2-propylvaleric acid,ergenyl,di-n-propylacetic acid,valproate,mylproin,pentanoic acid, 2-propyl PubChem CID: 3121 ChEBI: CHEBI:39867 IUPAC Name: 2-propylpentanoic acid SMILES: CCCC(CCC)C(O)=O
| PubChem CID | 3121 |
|---|---|
| CAS | 99-66-1 |
| Molecular Weight (g/mol) | 144.21 |
| ChEBI | CHEBI:39867 |
| MDL Number | MFCD00002672 |
| SMILES | CCCC(CCC)C(O)=O |
| Synonym | valproic acid,dipropylacetic acid,depakene,depakine,2-propylvaleric acid,ergenyl,di-n-propylacetic acid,valproate,mylproin,pentanoic acid, 2-propyl |
| IUPAC Name | 2-propylpentanoic acid |
| InChI Key | NIJJYAXOARWZEE-UHFFFAOYSA-N |
| Molecular Formula | C8H16O2 |
Thermo Scientific Chemicals Cytidine 5'-monophosphate hydrate, 99%
CAS: 63-37-6 Molecular Formula: C9H14N3O8P Molecular Weight (g/mol): 323.20 MDL Number: MFCD00006544 InChI Key: IERHLVCPSMICTF-NHBCCFCANA-N Synonym: 5'-cytidylic acid,cytidylic acid,cytidine 5'-monophosphate,cytidine monophosphate,cytidine-5'-monophosphate,5'-cmp,cytidylate,cytidine 5'-phosphate,cmp nucleotide,cytidine 5'-phosphoric acid PubChem CID: 6131 ChEBI: CHEBI:17361 IUPAC Name: [(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate SMILES: NC1=NC(=O)N(C=C1)[C@@H]1O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]1O
| PubChem CID | 6131 |
|---|---|
| CAS | 63-37-6 |
| Molecular Weight (g/mol) | 323.20 |
| ChEBI | CHEBI:17361 |
| MDL Number | MFCD00006544 |
| SMILES | NC1=NC(=O)N(C=C1)[C@@H]1O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]1O |
| Synonym | 5'-cytidylic acid,cytidylic acid,cytidine 5'-monophosphate,cytidine monophosphate,cytidine-5'-monophosphate,5'-cmp,cytidylate,cytidine 5'-phosphate,cmp nucleotide,cytidine 5'-phosphoric acid |
| IUPAC Name | [(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate |
| InChI Key | IERHLVCPSMICTF-NHBCCFCANA-N |
| Molecular Formula | C9H14N3O8P |
Methyl Cinnamate 99.0+%, TCI America™
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CAS: 103-26-4 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.188 MDL Number: MFCD00008458 InChI Key: CCRCUPLGCSFEDV-BQYQJAHWSA-N Synonym: methyl cinnamate,methyl trans-cinnamate,methyl e-cinnamate,cinnamic acid methyl ester,methyl cinnamylate,methyl 3-phenylacrylate,methyl e-3-phenylprop-2-enoate,methyl 3-phenylpropenoate,trans-cinnamic acid methyl ester,trans-methyl cinnamate PubChem CID: 637520 ChEBI: CHEBI:6857 IUPAC Name: methyl (E)-3-phenylprop-2-enoate SMILES: COC(=O)C=CC1=CC=CC=C1
| PubChem CID | 637520 |
|---|---|
| CAS | 103-26-4 |
| Molecular Weight (g/mol) | 162.188 |
| ChEBI | CHEBI:6857 |
| MDL Number | MFCD00008458 |
| SMILES | COC(=O)C=CC1=CC=CC=C1 |
| Synonym | methyl cinnamate,methyl trans-cinnamate,methyl e-cinnamate,cinnamic acid methyl ester,methyl cinnamylate,methyl 3-phenylacrylate,methyl e-3-phenylprop-2-enoate,methyl 3-phenylpropenoate,trans-cinnamic acid methyl ester,trans-methyl cinnamate |
| IUPAC Name | methyl (E)-3-phenylprop-2-enoate |
| InChI Key | CCRCUPLGCSFEDV-BQYQJAHWSA-N |
| Molecular Formula | C10H10O2 |
Mannose triflate, 98%
CAS: 92051-23-5 Molecular Formula: C15H19F3O12S Molecular Weight (g/mol): 480.36 InChI Key: OIBDVHSTOUGZTJ-PEBLQZBPSA-N Synonym: tatm,mannose triflate,1,3,4,6-tetra-o-acetyl-2-o-trifluoromethanesulfonyl-beta-d-mannopyranose,1,3,4,6-tetra-o-acetyl-2-o-trifluoromethanesulfonyl-b-d-mannopyranose,unii-0ki8ffq6tt,0ki8ffq6tt,beta-d-mannopyranose 1,3,4,6-tetra-o-acetate 2-o-trifluoromethanesulfonate,2r,3r,4s,5s,6s-3,4,6-tris acetyloxy-5-trifluoromethanesulfonyloxy oxan-2-yl methyl acetate,mannose trilfate PubChem CID: 11113597 IUPAC Name: [(2R,3R,4S,5S,6S)-3,4,6-triacetyloxy-5-(trifluoromethylsulfonyloxy)oxan-2-yl]methyl acetate SMILES: CC(=O)OCC1C(C(C(C(O1)OC(=O)C)OS(=O)(=O)C(F)(F)F)OC(=O)C)OC(=O)C
| PubChem CID | 11113597 |
|---|---|
| CAS | 92051-23-5 |
| Molecular Weight (g/mol) | 480.36 |
| SMILES | CC(=O)OCC1C(C(C(C(O1)OC(=O)C)OS(=O)(=O)C(F)(F)F)OC(=O)C)OC(=O)C |
| Synonym | tatm,mannose triflate,1,3,4,6-tetra-o-acetyl-2-o-trifluoromethanesulfonyl-beta-d-mannopyranose,1,3,4,6-tetra-o-acetyl-2-o-trifluoromethanesulfonyl-b-d-mannopyranose,unii-0ki8ffq6tt,0ki8ffq6tt,beta-d-mannopyranose 1,3,4,6-tetra-o-acetate 2-o-trifluoromethanesulfonate,2r,3r,4s,5s,6s-3,4,6-tris acetyloxy-5-trifluoromethanesulfonyloxy oxan-2-yl methyl acetate,mannose trilfate |
| IUPAC Name | [(2R,3R,4S,5S,6S)-3,4,6-triacetyloxy-5-(trifluoromethylsulfonyloxy)oxan-2-yl]methyl acetate |
| InChI Key | OIBDVHSTOUGZTJ-PEBLQZBPSA-N |
| Molecular Formula | C15H19F3O12S |
Sodium vinylsulfonate, tech. ca 25% aq. soln.
CAS: 3039-83-6 Molecular Formula: C2H3NaO3S Molecular Weight (g/mol): 130.09 MDL Number: MFCD00007520 InChI Key: BWYYYTVSBPRQCN-UHFFFAOYSA-M Synonym: sodium ethenesulfonate,sodium vinylsulfonate,ethenesulfonic acid, sodium salt,sodium ethylenesulfonate,sodium vinyl sulfonate,sodium ethylenesulphonate,sodium apolate,unii-f7k3l38z7b,sodium ethenesulfonate in h2o,lyapolate sodium usan PubChem CID: 3270262 IUPAC Name: sodium;ethenesulfonate SMILES: [Na+].[O-]S(=O)(=O)C=C
| PubChem CID | 3270262 |
|---|---|
| CAS | 3039-83-6 |
| Molecular Weight (g/mol) | 130.09 |
| MDL Number | MFCD00007520 |
| SMILES | [Na+].[O-]S(=O)(=O)C=C |
| Synonym | sodium ethenesulfonate,sodium vinylsulfonate,ethenesulfonic acid, sodium salt,sodium ethylenesulfonate,sodium vinyl sulfonate,sodium ethylenesulphonate,sodium apolate,unii-f7k3l38z7b,sodium ethenesulfonate in h2o,lyapolate sodium usan |
| IUPAC Name | sodium;ethenesulfonate |
| InChI Key | BWYYYTVSBPRQCN-UHFFFAOYSA-M |
| Molecular Formula | C2H3NaO3S |
2-Iodoacetamide 98.0+%, TCI America™
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CAS: 144-48-9 Molecular Formula: C2H4INO Molecular Weight (g/mol): 184.964 MDL Number: MFCD00008028 InChI Key: PGLTVOMIXTUURA-UHFFFAOYSA-N Synonym: iodoacetamide,monoiodoacetamide,surauto,acetamide, 2-iodo,2-iodo-acetamide,usaf d-1,alpha-iodoacetamide,ccris 7710,unii-zrh8m27s79,n-3-methoxy-4-butoxybenzyl thiobarbituric acid PubChem CID: 3727 IUPAC Name: 2-iodoacetamide SMILES: C(C(=O)N)I
| PubChem CID | 3727 |
|---|---|
| CAS | 144-48-9 |
| Molecular Weight (g/mol) | 184.964 |
| MDL Number | MFCD00008028 |
| SMILES | C(C(=O)N)I |
| Synonym | iodoacetamide,monoiodoacetamide,surauto,acetamide, 2-iodo,2-iodo-acetamide,usaf d-1,alpha-iodoacetamide,ccris 7710,unii-zrh8m27s79,n-3-methoxy-4-butoxybenzyl thiobarbituric acid |
| IUPAC Name | 2-iodoacetamide |
| InChI Key | PGLTVOMIXTUURA-UHFFFAOYSA-N |
| Molecular Formula | C2H4INO |
Hydrazine sulfate, 99+%
CAS: 10034-93-2 Molecular Formula: H6N2O4S Molecular Weight (g/mol): 130.118 MDL Number: MFCD00044873 InChI Key: ZGCHATBSUIJLRL-UHFFFAOYSA-N Synonym: hydrazine sulfate,hydrazine monosulfate,hydrazine, sulfate,hydrazine sulphate,hydrazinium sulfate,hydrazonium sulfate,hydrazine sulfate 1:1,segidrin,sehydrin,diamine sulfate PubChem CID: 24842 IUPAC Name: hydrazine;sulfuric acid SMILES: NN.OS(=O)(=O)O
| PubChem CID | 24842 |
|---|---|
| CAS | 10034-93-2 |
| Molecular Weight (g/mol) | 130.118 |
| MDL Number | MFCD00044873 |
| SMILES | NN.OS(=O)(=O)O |
| Synonym | hydrazine sulfate,hydrazine monosulfate,hydrazine, sulfate,hydrazine sulphate,hydrazinium sulfate,hydrazonium sulfate,hydrazine sulfate 1:1,segidrin,sehydrin,diamine sulfate |
| IUPAC Name | hydrazine;sulfuric acid |
| InChI Key | ZGCHATBSUIJLRL-UHFFFAOYSA-N |
| Molecular Formula | H6N2O4S |
Ethylenediaminetetraacetic Acid Dipotassium Salt Dihydrate, 99%
CAS: 25102-12-9 Molecular Formula: C10H18K2N2O10 Molecular Weight (g/mol): 404.455 MDL Number: MFCD00150036 InChI Key: JFROQFOCFOKDKU-UHFFFAOYSA-L Synonym: ethylenediaminetetraacetic acid dipotassium salt dihydrate,dipotassium dihydrogen ethylenediaminetetraacetate dihydrate,potassium 2,2'-2-bis carboxymethyl amino ethyl azanediyl diacetate dihydrate,edta dipotassium salt dihydrate,edta dipotassium salt,ethylenediaminetetraacetic acid,dipotassium salt dihydrate,potassium ethylenediaminetetraacetate dibasic,dipotassium ethylenediaminetetraacetate dihydrate,ethylenedinitrilo tetraacetic acid dipotassium salt,acmc-209ggx PubChem CID: 53486451 IUPAC Name: dipotassium;2-[2-[bis(carboxymethyl)amino]ethyl-(carboxylatomethyl)amino]acetate;dihydrate SMILES: C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)O)CC(=O)O.O.O.[K+].[K+]
| PubChem CID | 53486451 |
|---|---|
| CAS | 25102-12-9 |
| Molecular Weight (g/mol) | 404.455 |
| MDL Number | MFCD00150036 |
| SMILES | C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)O)CC(=O)O.O.O.[K+].[K+] |
| Synonym | ethylenediaminetetraacetic acid dipotassium salt dihydrate,dipotassium dihydrogen ethylenediaminetetraacetate dihydrate,potassium 2,2'-2-bis carboxymethyl amino ethyl azanediyl diacetate dihydrate,edta dipotassium salt dihydrate,edta dipotassium salt,ethylenediaminetetraacetic acid,dipotassium salt dihydrate,potassium ethylenediaminetetraacetate dibasic,dipotassium ethylenediaminetetraacetate dihydrate,ethylenedinitrilo tetraacetic acid dipotassium salt,acmc-209ggx |
| IUPAC Name | dipotassium;2-[2-[bis(carboxymethyl)amino]ethyl-(carboxylatomethyl)amino]acetate;dihydrate |
| InChI Key | JFROQFOCFOKDKU-UHFFFAOYSA-L |
| Molecular Formula | C10H18K2N2O10 |
trans-10-Hydroxy-2-decenoic Acid 97.0+%, TCI America™
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CAS: 14113-05-4 Molecular Formula: C10H18O3 Molecular Weight (g/mol): 186.25 MDL Number: MFCD00204506 InChI Key: QHBZHVUGQROELI-SOFGYWHQSA-N PubChem CID: 5312738 ChEBI: CHEBI:78668 IUPAC Name: (2E)-10-hydroxydec-2-enoic acid SMILES: OCCCCCCC\C=C\C(O)=O
| PubChem CID | 5312738 |
|---|---|
| CAS | 14113-05-4 |
| Molecular Weight (g/mol) | 186.25 |
| ChEBI | CHEBI:78668 |
| MDL Number | MFCD00204506 |
| SMILES | OCCCCCCC\C=C\C(O)=O |
| IUPAC Name | (2E)-10-hydroxydec-2-enoic acid |
| InChI Key | QHBZHVUGQROELI-SOFGYWHQSA-N |
| Molecular Formula | C10H18O3 |
Glycine anhydride, 98%
CAS: 106-57-0 Molecular Formula: C4H6N2O2 Molecular Weight (g/mol): 114.1 MDL Number: MFCD00006009 InChI Key: BXRNXXXXHLBUKK-UHFFFAOYSA-N Synonym: 2,5-piperazinedione,2,5-dioxopiperazine,2,5-diketopiperazine,cyclodiglycine,cycloglycylglycine,cyclo glycylglycyl,glycylglycine lactam,diglycolyl diamide,glycine, bimol. cyclic peptide,alpha,gamma-diacipiperazine PubChem CID: 7817 ChEBI: CHEBI:16535 IUPAC Name: piperazine-2,5-dione SMILES: C1C(=O)NCC(=O)N1
| PubChem CID | 7817 |
|---|---|
| CAS | 106-57-0 |
| Molecular Weight (g/mol) | 114.1 |
| ChEBI | CHEBI:16535 |
| MDL Number | MFCD00006009 |
| SMILES | C1C(=O)NCC(=O)N1 |
| Synonym | 2,5-piperazinedione,2,5-dioxopiperazine,2,5-diketopiperazine,cyclodiglycine,cycloglycylglycine,cyclo glycylglycyl,glycylglycine lactam,diglycolyl diamide,glycine, bimol. cyclic peptide,alpha,gamma-diacipiperazine |
| IUPAC Name | piperazine-2,5-dione |
| InChI Key | BXRNXXXXHLBUKK-UHFFFAOYSA-N |
| Molecular Formula | C4H6N2O2 |