Organic acids and derivatives
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3-Aminobenzeneboronic acid hemisulfate, 98+%
CAS: 66472-86-4 Molecular Formula: C12H18B2N2O8S Molecular Weight (g/mol): 371.96 MDL Number: MFCD00013111 InChI Key: UKTAURVTSWDIQR-UHFFFAOYSA-N Synonym: 3-aminophenyl boronic acid sulfate 2:1,3-aminobenzeneboronic acid hemisulfate salt,3-aminophenylboronic acid hemisulfate,3-aminobenzeneboronic acid hemisulfate,3-aminophenylboronic acid hemisulphate,4-aminophenylboronic acid hemisulfate,m-aminophenyl boronic acid, hemisulphate,boronic acid, 3-aminophenyl-, sulfate 2:1,3-aminophenyl boronic acid; sulfuric acid,bis m-aminophenylboronic acid ; sulfuric acid PubChem CID: 16211139 IUPAC Name: (3-aminophenyl)boronic acid;sulfuric acid SMILES: OS(O)(=O)=O.NC1=CC=CC(=C1)B(O)O.NC1=CC=CC(=C1)B(O)O
| PubChem CID | 16211139 |
|---|---|
| CAS | 66472-86-4 |
| Molecular Weight (g/mol) | 371.96 |
| MDL Number | MFCD00013111 |
| SMILES | OS(O)(=O)=O.NC1=CC=CC(=C1)B(O)O.NC1=CC=CC(=C1)B(O)O |
| Synonym | 3-aminophenyl boronic acid sulfate 2:1,3-aminobenzeneboronic acid hemisulfate salt,3-aminophenylboronic acid hemisulfate,3-aminobenzeneboronic acid hemisulfate,3-aminophenylboronic acid hemisulphate,4-aminophenylboronic acid hemisulfate,m-aminophenyl boronic acid, hemisulphate,boronic acid, 3-aminophenyl-, sulfate 2:1,3-aminophenyl boronic acid; sulfuric acid,bis m-aminophenylboronic acid ; sulfuric acid |
| IUPAC Name | (3-aminophenyl)boronic acid;sulfuric acid |
| InChI Key | UKTAURVTSWDIQR-UHFFFAOYSA-N |
| Molecular Formula | C12H18B2N2O8S |
Diethyl (phthalimidomethyl)phosphonate, 97%
CAS: 33512-26-4 Molecular Formula: C13H16NO5P Molecular Weight (g/mol): 297.247 MDL Number: MFCD00134313 InChI Key: IUZMHUAHKBHJFY-UHFFFAOYSA-N Synonym: diethyl phthalimidomethyl phosphonate,diethyl 1,3-dioxoisoindolin-2-yl methyl phosphonate,phthalimidomethyl phosphonic acid diethyl ester,diethyl 1,3-dioxoisoindol-2-yl methylphosphonate,2-diethoxycarbonyl methyl benzo c azoline-1,3-dione,acmc-1cp9b,diethyl phthalimidomethylphosphonate,n-diethoxyphosphoryl methyl phthalimide PubChem CID: 1924456 IUPAC Name: 2-(diethoxyphosphorylmethyl)isoindole-1,3-dione SMILES: CCOP(=O)(CN1C(=O)C2=CC=CC=C2C1=O)OCC
| PubChem CID | 1924456 |
|---|---|
| CAS | 33512-26-4 |
| Molecular Weight (g/mol) | 297.247 |
| MDL Number | MFCD00134313 |
| SMILES | CCOP(=O)(CN1C(=O)C2=CC=CC=C2C1=O)OCC |
| Synonym | diethyl phthalimidomethyl phosphonate,diethyl 1,3-dioxoisoindolin-2-yl methyl phosphonate,phthalimidomethyl phosphonic acid diethyl ester,diethyl 1,3-dioxoisoindol-2-yl methylphosphonate,2-diethoxycarbonyl methyl benzo c azoline-1,3-dione,acmc-1cp9b,diethyl phthalimidomethylphosphonate,n-diethoxyphosphoryl methyl phthalimide |
| IUPAC Name | 2-(diethoxyphosphorylmethyl)isoindole-1,3-dione |
| InChI Key | IUZMHUAHKBHJFY-UHFFFAOYSA-N |
| Molecular Formula | C13H16NO5P |
Methyl (S)-(-)-lactate, 97%
CAS: 27871-49-4 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.11 MDL Number: MFCD00064265 InChI Key: LPEKGGXMPWTOCB-VKHMYHEASA-N Synonym: methyl s---lactate,methyl l-lactate,s-methyl lactate,--methyl l-lactate,s-lactic acid methyl ester,methyl 2s-2-hydroxypropanoate,--methyl lactate,methyl s-2-hydroxypropionate,propanoic acid, 2-hydroxy-, methyl ester, 2s,--lactic acid methyl ester PubChem CID: 94386 ChEBI: CHEBI:83222 IUPAC Name: methyl (2S)-2-hydroxypropanoate SMILES: COC(=O)[C@H](C)O
| PubChem CID | 94386 |
|---|---|
| CAS | 27871-49-4 |
| Molecular Weight (g/mol) | 104.11 |
| ChEBI | CHEBI:83222 |
| MDL Number | MFCD00064265 |
| SMILES | COC(=O)[C@H](C)O |
| Synonym | methyl s---lactate,methyl l-lactate,s-methyl lactate,--methyl l-lactate,s-lactic acid methyl ester,methyl 2s-2-hydroxypropanoate,--methyl lactate,methyl s-2-hydroxypropionate,propanoic acid, 2-hydroxy-, methyl ester, 2s,--lactic acid methyl ester |
| IUPAC Name | methyl (2S)-2-hydroxypropanoate |
| InChI Key | LPEKGGXMPWTOCB-VKHMYHEASA-N |
| Molecular Formula | C4H8O3 |
1,4-Benzenediboronic acid, 96%
CAS: 4612-26-4 Molecular Formula: C6H8B2O4 Molecular Weight (g/mol): 165.746 MDL Number: MFCD00236018 InChI Key: BODYVHJTUHHINQ-UHFFFAOYSA-N Synonym: 1,4-benzenediboronic acid,1,4-phenylenediboronic acid,1,4-phenylenebisboronic acid,benzene-1,4-diboronic acid,4-boronophenyl boronic acid,p-benzenediboronic acid,p-phenylenediboronic acid,1,4-phenylenebis boronic acid,1,4 phenyl diboronic acid,boronic acid, 1,4-phenylenebis PubChem CID: 230478 IUPAC Name: (4-boronophenyl)boronic acid SMILES: B(C1=CC=C(C=C1)B(O)O)(O)O
| PubChem CID | 230478 |
|---|---|
| CAS | 4612-26-4 |
| Molecular Weight (g/mol) | 165.746 |
| MDL Number | MFCD00236018 |
| SMILES | B(C1=CC=C(C=C1)B(O)O)(O)O |
| Synonym | 1,4-benzenediboronic acid,1,4-phenylenediboronic acid,1,4-phenylenebisboronic acid,benzene-1,4-diboronic acid,4-boronophenyl boronic acid,p-benzenediboronic acid,p-phenylenediboronic acid,1,4-phenylenebis boronic acid,1,4 phenyl diboronic acid,boronic acid, 1,4-phenylenebis |
| IUPAC Name | (4-boronophenyl)boronic acid |
| InChI Key | BODYVHJTUHHINQ-UHFFFAOYSA-N |
| Molecular Formula | C6H8B2O4 |
Sodium dichloroacetate, 96%
CAS: 2156-56-1 Molecular Formula: C2HCl2NaO2 Molecular Weight (g/mol): 150.92 MDL Number: MFCD00070489 InChI Key: LUPNKHXLFSSUGS-UHFFFAOYSA-M Synonym: sodium dichloroacetate,sodium 2,2-dichloroacetate,dichloroacetic acid sodium salt,acetic acid, dichloro-, sodium salt,ceresine,dichloroacetate sodium,dichloroctan sodny czech,sodium dichloroacetate usan,ccris 7697,dichloroacetic acid, sodium salt PubChem CID: 517326 IUPAC Name: sodium;2,2-dichloroacetate SMILES: [Na+].[O-]C(=O)C(Cl)Cl
| PubChem CID | 517326 |
|---|---|
| CAS | 2156-56-1 |
| Molecular Weight (g/mol) | 150.92 |
| MDL Number | MFCD00070489 |
| SMILES | [Na+].[O-]C(=O)C(Cl)Cl |
| Synonym | sodium dichloroacetate,sodium 2,2-dichloroacetate,dichloroacetic acid sodium salt,acetic acid, dichloro-, sodium salt,ceresine,dichloroacetate sodium,dichloroctan sodny czech,sodium dichloroacetate usan,ccris 7697,dichloroacetic acid, sodium salt |
| IUPAC Name | sodium;2,2-dichloroacetate |
| InChI Key | LUPNKHXLFSSUGS-UHFFFAOYSA-M |
| Molecular Formula | C2HCl2NaO2 |
Diethyl 4-aminobenzylphosphonate, 99%
CAS: 20074-79-7 Molecular Formula: C11H18NO3P Molecular Weight (g/mol): 243.24 MDL Number: MFCD00007913 InChI Key: ZVAYUUUQOCPZCZ-UHFFFAOYSA-N Synonym: diethyl 4-aminobenzylphosphonate,diethyl p-aminobenzylphosphonate,4-diethoxyphosphorylmethyl aniline,p-aminobenzylphosphonic acid diethyl ester,diethyl p-aminobenzyl phosphonate,phosphonic acid, p-aminobenzyl-, diethyl ester,diethyl 4-aminophenyl methylphosphonate,phosphonic acid, 4-aminophenyl methyl-, diethyl ester,timtec-bb sbb000830 PubChem CID: 88358 SMILES: CCOP(=O)(CC1=CC=C(N)C=C1)OCC
| PubChem CID | 88358 |
|---|---|
| CAS | 20074-79-7 |
| Molecular Weight (g/mol) | 243.24 |
| MDL Number | MFCD00007913 |
| SMILES | CCOP(=O)(CC1=CC=C(N)C=C1)OCC |
| Synonym | diethyl 4-aminobenzylphosphonate,diethyl p-aminobenzylphosphonate,4-diethoxyphosphorylmethyl aniline,p-aminobenzylphosphonic acid diethyl ester,diethyl p-aminobenzyl phosphonate,phosphonic acid, p-aminobenzyl-, diethyl ester,diethyl 4-aminophenyl methylphosphonate,phosphonic acid, 4-aminophenyl methyl-, diethyl ester,timtec-bb sbb000830 |
| InChI Key | ZVAYUUUQOCPZCZ-UHFFFAOYSA-N |
| Molecular Formula | C11H18NO3P |
1-Cyano-1-cyclopropanecarboxylic acid, 97%
CAS: 6914-79-0 Molecular Formula: C5H4NO2 Molecular Weight (g/mol): 110.09 MDL Number: MFCD00190651 InChI Key: KSJJMSKNZVXAND-UHFFFAOYSA-M Synonym: 1-cyanocyclopropanecarboxylic acid,1-cyano-1-cyclopropanecarboxylic acid,cyanocyclopropanecarboxylic acid,cyclopropanecarboxylic acid, 1-cyano,cyclopropane, 4,1-cyanocyclopropane-carboxylic acid,1-cyano-1-cyclopropanecarboxylicacid,1-cyano-cyclo-propanecarboxylic acid,1-cyano-1-cyclopropane carboxylic acid,1-cyano-1-cyclopropane-carboxylic acid PubChem CID: 2733259 IUPAC Name: 1-cyanocyclopropane-1-carboxylic acid SMILES: [O-]C(=O)C1(CC1)C#N
| PubChem CID | 2733259 |
|---|---|
| CAS | 6914-79-0 |
| Molecular Weight (g/mol) | 110.09 |
| MDL Number | MFCD00190651 |
| SMILES | [O-]C(=O)C1(CC1)C#N |
| Synonym | 1-cyanocyclopropanecarboxylic acid,1-cyano-1-cyclopropanecarboxylic acid,cyanocyclopropanecarboxylic acid,cyclopropanecarboxylic acid, 1-cyano,cyclopropane, 4,1-cyanocyclopropane-carboxylic acid,1-cyano-1-cyclopropanecarboxylicacid,1-cyano-cyclo-propanecarboxylic acid,1-cyano-1-cyclopropane carboxylic acid,1-cyano-1-cyclopropane-carboxylic acid |
| IUPAC Name | 1-cyanocyclopropane-1-carboxylic acid |
| InChI Key | KSJJMSKNZVXAND-UHFFFAOYSA-M |
| Molecular Formula | C5H4NO2 |
Sodium 1-tetradecyl sulfate, 95%, cont. up to ca 5% sodium methyl sulfate
CAS: 1191-50-0 Molecular Formula: C14H29NaO4S Molecular Weight (g/mol): 316.43 MDL Number: MFCD00007468 InChI Key: UPUIQOIQVMNQAP-UHFFFAOYSA-M Synonym: sodium tetradecyl sulfate,sodium myristyl sulfate,niaproof 4,sodium tetradecyl sulphate,tesapon k 14,texapon k 14,trombavar,natri tetradecylsulfas,sotradecol sodium,tetradecyl sodium sulfate PubChem CID: 23665770 IUPAC Name: sodium;tetradecyl sulfate SMILES: [Na+].CCCCCCCCCCCCCCOS([O-])(=O)=O
| PubChem CID | 23665770 |
|---|---|
| CAS | 1191-50-0 |
| Molecular Weight (g/mol) | 316.43 |
| MDL Number | MFCD00007468 |
| SMILES | [Na+].CCCCCCCCCCCCCCOS([O-])(=O)=O |
| Synonym | sodium tetradecyl sulfate,sodium myristyl sulfate,niaproof 4,sodium tetradecyl sulphate,tesapon k 14,texapon k 14,trombavar,natri tetradecylsulfas,sotradecol sodium,tetradecyl sodium sulfate |
| IUPAC Name | sodium;tetradecyl sulfate |
| InChI Key | UPUIQOIQVMNQAP-UHFFFAOYSA-M |
| Molecular Formula | C14H29NaO4S |
Aminomethanesulfonic acid, 97%
CAS: 13881-91-9 Molecular Formula: CH5NO3S Molecular Weight (g/mol): 111.115 MDL Number: MFCD00008124 InChI Key: OBESRABRARNZJB-UHFFFAOYSA-N Synonym: methanesulfonic acid, amino,aminomethanesulphonic acid,aminomethyl sulfonic acid,aminomethylsulfonic acid,unii-ola224z482,methanesulfonic acid, 1-amino,aminomethanesulfonicacid,sodium aminomethanesulphonate,aminomethanesulfonic,aminomethanesulfoniccid PubChem CID: 83791 IUPAC Name: aminomethanesulfonic acid SMILES: C(N)S(=O)(=O)O
| PubChem CID | 83791 |
|---|---|
| CAS | 13881-91-9 |
| Molecular Weight (g/mol) | 111.115 |
| MDL Number | MFCD00008124 |
| SMILES | C(N)S(=O)(=O)O |
| Synonym | methanesulfonic acid, amino,aminomethanesulphonic acid,aminomethyl sulfonic acid,aminomethylsulfonic acid,unii-ola224z482,methanesulfonic acid, 1-amino,aminomethanesulfonicacid,sodium aminomethanesulphonate,aminomethanesulfonic,aminomethanesulfoniccid |
| IUPAC Name | aminomethanesulfonic acid |
| InChI Key | OBESRABRARNZJB-UHFFFAOYSA-N |
| Molecular Formula | CH5NO3S |
4-Ethoxybenzeneboronic acid, 98%
CAS: 22237-13-4 Molecular Formula: C8H11BO3 Molecular Weight (g/mol): 165.983 MDL Number: MFCD00674028 InChI Key: WRQNDLDUNQMTCL-UHFFFAOYSA-N Synonym: 4-ethoxybenzeneboronic acid,4-ethoxyphenyl boronic acid,4-ethoxyphenyl boranediol,p-ethoxyphenylboronic acid,4-n-ethoxyphenyl boronic acid,boronic acid, 4-ethoxyphenyl,4-ethoxybenzeneboronicacid,4-ethoxyphenylboronicacid,4-ethoxyphenylboronic PubChem CID: 2734351 IUPAC Name: (4-ethoxyphenyl)boronic acid SMILES: B(C1=CC=C(C=C1)OCC)(O)O
| PubChem CID | 2734351 |
|---|---|
| CAS | 22237-13-4 |
| Molecular Weight (g/mol) | 165.983 |
| MDL Number | MFCD00674028 |
| SMILES | B(C1=CC=C(C=C1)OCC)(O)O |
| Synonym | 4-ethoxybenzeneboronic acid,4-ethoxyphenyl boronic acid,4-ethoxyphenyl boranediol,p-ethoxyphenylboronic acid,4-n-ethoxyphenyl boronic acid,boronic acid, 4-ethoxyphenyl,4-ethoxybenzeneboronicacid,4-ethoxyphenylboronicacid,4-ethoxyphenylboronic |
| IUPAC Name | (4-ethoxyphenyl)boronic acid |
| InChI Key | WRQNDLDUNQMTCL-UHFFFAOYSA-N |
| Molecular Formula | C8H11BO3 |
3-Methyl-1H-pyrazole-5-carboxylic acid, 97%
CAS: 402-61-9 Molecular Formula: C5H6N2O2 Molecular Weight (g/mol): 126.115 MDL Number: MFCD00462235 InChI Key: WSMQKESQZFQMFW-UHFFFAOYSA-N Synonym: 3-methyl-1h-pyrazole-5-carboxylic acid,5-methylpyrazole-3-carboxylic acid,5-methyl-2h-pyrazole-3-carboxylic acid,3-methylpyrazole-5-carboxylic acid,1h-pyrazole-3-carboxylicacid, 5-methyl,5-methylpyrazole-3-carboxylicacid,3-methyl-1h-pyrazole-5-carboxylicacid,pyrazole-3-carboxylic acid, 5-methyl,pubchem7842,5-methyl-2h-pyrazole-3-carboxylicacid PubChem CID: 9822 ChEBI: CHEBI:74739 IUPAC Name: 5-methyl-1H-pyrazole-3-carboxylic acid SMILES: CC1=CC(=NN1)C(=O)O
| PubChem CID | 9822 |
|---|---|
| CAS | 402-61-9 |
| Molecular Weight (g/mol) | 126.115 |
| ChEBI | CHEBI:74739 |
| MDL Number | MFCD00462235 |
| SMILES | CC1=CC(=NN1)C(=O)O |
| Synonym | 3-methyl-1h-pyrazole-5-carboxylic acid,5-methylpyrazole-3-carboxylic acid,5-methyl-2h-pyrazole-3-carboxylic acid,3-methylpyrazole-5-carboxylic acid,1h-pyrazole-3-carboxylicacid, 5-methyl,5-methylpyrazole-3-carboxylicacid,3-methyl-1h-pyrazole-5-carboxylicacid,pyrazole-3-carboxylic acid, 5-methyl,pubchem7842,5-methyl-2h-pyrazole-3-carboxylicacid |
| IUPAC Name | 5-methyl-1H-pyrazole-3-carboxylic acid |
| InChI Key | WSMQKESQZFQMFW-UHFFFAOYSA-N |
| Molecular Formula | C5H6N2O2 |
Vinyl decanoate, 95%, stab.
CAS: 4704-31-8 Molecular Formula: C12H22O2 Molecular Weight (g/mol): 198.306 MDL Number: MFCD00027349 InChI Key: CMDXMIHZUJPRHG-UHFFFAOYSA-N Synonym: vinyl decanoate,decanoic acid, vinyl ester,vinyl n-decanoate,unii-ff00i399li,decanoic acid, ethenyl ester,n-capric acid vinyl ester,decanoic acid vinyl,acmc-1aqz4,decanoic acid vinyl ester,capric acid vinyl ester = vinyl decenoate PubChem CID: 62140 IUPAC Name: ethenyl decanoate SMILES: CCCCCCCCCC(=O)OC=C
| PubChem CID | 62140 |
|---|---|
| CAS | 4704-31-8 |
| Molecular Weight (g/mol) | 198.306 |
| MDL Number | MFCD00027349 |
| SMILES | CCCCCCCCCC(=O)OC=C |
| Synonym | vinyl decanoate,decanoic acid, vinyl ester,vinyl n-decanoate,unii-ff00i399li,decanoic acid, ethenyl ester,n-capric acid vinyl ester,decanoic acid vinyl,acmc-1aqz4,decanoic acid vinyl ester,capric acid vinyl ester = vinyl decenoate |
| IUPAC Name | ethenyl decanoate |
| InChI Key | CMDXMIHZUJPRHG-UHFFFAOYSA-N |
| Molecular Formula | C12H22O2 |
Ethanesulfonic acid sodium salt, 98%, may cont. ca 2% water
CAS: 5324-47-0 Molecular Formula: C2H5NaO3S Molecular Weight (g/mol): 132.109 MDL Number: MFCD00066498 InChI Key: KQFAFFYKLIBKDE-UHFFFAOYSA-M Synonym: sodium ethanesulfonate,sodium ethanesulphonate,ethanesulfonic acid sodium salt,ethanesulfonic acid, sodium salt,ethane sulfonic acid sodium salt,sodiumethanesulfonate,sodium ethylsulfonate,sodium esylate,sodium ethane sulfonate,ethylsulfonic acid sodium salt PubChem CID: 4192170 IUPAC Name: sodium;ethanesulfonate SMILES: CCS(=O)(=O)[O-].[Na+]
| PubChem CID | 4192170 |
|---|---|
| CAS | 5324-47-0 |
| Molecular Weight (g/mol) | 132.109 |
| MDL Number | MFCD00066498 |
| SMILES | CCS(=O)(=O)[O-].[Na+] |
| Synonym | sodium ethanesulfonate,sodium ethanesulphonate,ethanesulfonic acid sodium salt,ethanesulfonic acid, sodium salt,ethane sulfonic acid sodium salt,sodiumethanesulfonate,sodium ethylsulfonate,sodium esylate,sodium ethane sulfonate,ethylsulfonic acid sodium salt |
| IUPAC Name | sodium;ethanesulfonate |
| InChI Key | KQFAFFYKLIBKDE-UHFFFAOYSA-M |
| Molecular Formula | C2H5NaO3S |
1-Hexanesulfonic Acid Sodium Salt, Monohydrate, 98%, Spectrum™ Chemical
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CAS: 207300-91-2
| CAS | 207300-91-2 |
|---|
3-Butynyl p-toluenesulfonate, 96%
CAS: 23418-85-1 Molecular Formula: C11H12O3S Molecular Weight (g/mol): 224.274 MDL Number: MFCD00041687 InChI Key: STOASOOVVADOKH-UHFFFAOYSA-N Synonym: 3-butynyl p-toluenesulfonate,but-3-yn-1-yl 4-methylbenzenesulfonate,3-butynyl tosylate,3-butynyl 4-toluenesulfonate,3-1-butynyl-4-toluenesulphonate,3-butynyl 4-methylbenzenesulfonate,p-toluenesulfonic acid 3-butynyl ester,but-3-ynyl tosylate,4-tosyloxy-1-butyne,acmc-1cgfq PubChem CID: 272020 IUPAC Name: but-3-ynyl 4-methylbenzenesulfonate SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCCC#C
| PubChem CID | 272020 |
|---|---|
| CAS | 23418-85-1 |
| Molecular Weight (g/mol) | 224.274 |
| MDL Number | MFCD00041687 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OCCC#C |
| Synonym | 3-butynyl p-toluenesulfonate,but-3-yn-1-yl 4-methylbenzenesulfonate,3-butynyl tosylate,3-butynyl 4-toluenesulfonate,3-1-butynyl-4-toluenesulphonate,3-butynyl 4-methylbenzenesulfonate,p-toluenesulfonic acid 3-butynyl ester,but-3-ynyl tosylate,4-tosyloxy-1-butyne,acmc-1cgfq |
| IUPAC Name | but-3-ynyl 4-methylbenzenesulfonate |
| InChI Key | STOASOOVVADOKH-UHFFFAOYSA-N |
| Molecular Formula | C11H12O3S |