Organic acids and derivatives
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Selectophore™ Tris(2-ethylhexyl) phosphate, ≥99.0%, MilliporeSigma™ Supelco™
MDL Number: MFCD00009491 Synonym: ′Trioctyl′ phosphate
| MDL Number | MFCD00009491 |
|---|---|
| Synonym | ′Trioctyl′ phosphate |
Ammonium formate Solution, For HPLC, 10 mM in Water, MilliporeSigma™ Supelco™
MDL Number: MFCD00013103
| MDL Number | MFCD00013103 |
|---|
mono-n-Dodecyl phosphate, tech. 90%
CAS: 2627-35-2 Molecular Formula: C12H27O4P Molecular Weight (g/mol): 266.32 MDL Number: MFCD00013946 InChI Key: TVACALAUIQMRDF-UHFFFAOYSA-N Synonym: dodecyl phosphate,monolauryl phosphate,phosphoric acid, monododecyl ester,mono-n-dodecyl phosphate,monododecyl phosphate,dihydrogen monolauryl phosphate,lauryl dihydrogen phosphate,unii-0k08l8ge2h,phosphoric acid monododecyl ester,dodecyloxyphosphonic acid PubChem CID: 75816 IUPAC Name: dodecyl dihydrogen phosphate SMILES: CCCCCCCCCCCCOP(O)(O)=O
| PubChem CID | 75816 |
|---|---|
| CAS | 2627-35-2 |
| Molecular Weight (g/mol) | 266.32 |
| MDL Number | MFCD00013946 |
| SMILES | CCCCCCCCCCCCOP(O)(O)=O |
| Synonym | dodecyl phosphate,monolauryl phosphate,phosphoric acid, monododecyl ester,mono-n-dodecyl phosphate,monododecyl phosphate,dihydrogen monolauryl phosphate,lauryl dihydrogen phosphate,unii-0k08l8ge2h,phosphoric acid monododecyl ester,dodecyloxyphosphonic acid |
| IUPAC Name | dodecyl dihydrogen phosphate |
| InChI Key | TVACALAUIQMRDF-UHFFFAOYSA-N |
| Molecular Formula | C12H27O4P |
N,N-Dimethylformamide dineopentyl acetal, 98%
CAS: 4909-78-8 Molecular Formula: C13H30NO2 Molecular Weight (g/mol): 232.39 MDL Number: MFCD00008851 InChI Key: KEXFRBIOHPDZQM-UHFFFAOYSA-O Synonym: n,n-dimethylformamide dineopentyl acetal,methanamine, 1,1-bis 2,2-dimethylpropoxy-n,n-dimethyl,n,n-dimethyl-1,1-bis neopentyloxy methanamine,dimethylformamide dineopentyl acetal,1,1-bis 2,2-dimethylpropoxy-n,n-dimethylmethanamine,bis 2,2-dimethylpropoxy methyl dimethylamine,acmc-1al8s,1,1-bis 2,2-dimethylpropoxy-n,n,n-trimethylamine,1,1-dineopentyloxytrimethylamine,dimethylformamide dineopentylacetal PubChem CID: 78623 IUPAC Name: 1,1-bis(2,2-dimethylpropoxy)-N,N-dimethylmethanamine SMILES: C[NH+](C)C(OCC(C)(C)C)OCC(C)(C)C
| PubChem CID | 78623 |
|---|---|
| CAS | 4909-78-8 |
| Molecular Weight (g/mol) | 232.39 |
| MDL Number | MFCD00008851 |
| SMILES | C[NH+](C)C(OCC(C)(C)C)OCC(C)(C)C |
| Synonym | n,n-dimethylformamide dineopentyl acetal,methanamine, 1,1-bis 2,2-dimethylpropoxy-n,n-dimethyl,n,n-dimethyl-1,1-bis neopentyloxy methanamine,dimethylformamide dineopentyl acetal,1,1-bis 2,2-dimethylpropoxy-n,n-dimethylmethanamine,bis 2,2-dimethylpropoxy methyl dimethylamine,acmc-1al8s,1,1-bis 2,2-dimethylpropoxy-n,n,n-trimethylamine,1,1-dineopentyloxytrimethylamine,dimethylformamide dineopentylacetal |
| IUPAC Name | 1,1-bis(2,2-dimethylpropoxy)-N,N-dimethylmethanamine |
| InChI Key | KEXFRBIOHPDZQM-UHFFFAOYSA-O |
| Molecular Formula | C13H30NO2 |
ethyle2-amino-4-(4-bromophenyl)-3-thiophenecarboxylate, 97%, Thermo Scientific™
CAS: 306934-99-6 Molecular Formula: C13H12BrNO2S Molecular Weight (g/mol): 326.208 MDL Number: MFCD00435056 InChI Key: SEWFWRCESBYGFS-UHFFFAOYSA-N PubChem CID: 727636 IUPAC Name: ethyl 2-amino-4-(4-bromophenyl)thiophene-3-carboxylate SMILES: CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)N
| PubChem CID | 727636 |
|---|---|
| CAS | 306934-99-6 |
| Molecular Weight (g/mol) | 326.208 |
| MDL Number | MFCD00435056 |
| SMILES | CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)N |
| IUPAC Name | ethyl 2-amino-4-(4-bromophenyl)thiophene-3-carboxylate |
| InChI Key | SEWFWRCESBYGFS-UHFFFAOYSA-N |
| Molecular Formula | C13H12BrNO2S |
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 |
1-Phenylcyclohexanecarboxylic acid, 99%
CAS: 1135-67-7 Molecular Formula: C13H16O2 Molecular Weight (g/mol): 204.269 MDL Number: MFCD00037152 InChI Key: QXXHHHWXFHPNOS-UHFFFAOYSA-N Synonym: 1-phenylcyclohexanecarboxylic acid,1-phenyl-1-cyclohexanecarboxylic acid,1-phenyl-cyclohexanecarboxylic acid,cyclohexanecarboxylic acid, 1-phenyl,acmc-1c6ij,1-phenylcyclohexanecarboxylicacid,qxxhhhwxfhpnos-uhfffaoysa,1-phenylcyclohexanecarboxylic acid #,cyclohexanecarboxylicacid, 1-phenyl,1-phenyl-1-cyclohexane carboxylic acid PubChem CID: 70817 IUPAC Name: 1-phenylcyclohexane-1-carboxylic acid SMILES: C1CCC(CC1)(C2=CC=CC=C2)C(=O)O
| PubChem CID | 70817 |
|---|---|
| CAS | 1135-67-7 |
| Molecular Weight (g/mol) | 204.269 |
| MDL Number | MFCD00037152 |
| SMILES | C1CCC(CC1)(C2=CC=CC=C2)C(=O)O |
| Synonym | 1-phenylcyclohexanecarboxylic acid,1-phenyl-1-cyclohexanecarboxylic acid,1-phenyl-cyclohexanecarboxylic acid,cyclohexanecarboxylic acid, 1-phenyl,acmc-1c6ij,1-phenylcyclohexanecarboxylicacid,qxxhhhwxfhpnos-uhfffaoysa,1-phenylcyclohexanecarboxylic acid #,cyclohexanecarboxylicacid, 1-phenyl,1-phenyl-1-cyclohexane carboxylic acid |
| IUPAC Name | 1-phenylcyclohexane-1-carboxylic acid |
| InChI Key | QXXHHHWXFHPNOS-UHFFFAOYSA-N |
| Molecular Formula | C13H16O2 |
1,3-Propanedisulfonic acid disodium salt, 99% (dry wt.)
CAS: 36589-58-9 Molecular Formula: C3H6Na2O6S2 Molecular Weight (g/mol): 248.175 MDL Number: MFCD00191483 InChI Key: DKGJFKPIUSHDIT-UHFFFAOYSA-L Synonym: eprodisate disodium,disodium 1,3-propanedisulfonate,kiacta,disodium propane-1,3-disulfonate,eprodisate sodium,unii-5x0d9h16iu,1,3-propanedisulfonic acid disodium salt,eprodisate disodium usan,1,3-propanedisulfonic acid, disodium salt PubChem CID: 6451143 IUPAC Name: disodium;propane-1,3-disulfonate SMILES: C(CS(=O)(=O)[O-])CS(=O)(=O)[O-].[Na+].[Na+]
| PubChem CID | 6451143 |
|---|---|
| CAS | 36589-58-9 |
| Molecular Weight (g/mol) | 248.175 |
| MDL Number | MFCD00191483 |
| SMILES | C(CS(=O)(=O)[O-])CS(=O)(=O)[O-].[Na+].[Na+] |
| Synonym | eprodisate disodium,disodium 1,3-propanedisulfonate,kiacta,disodium propane-1,3-disulfonate,eprodisate sodium,unii-5x0d9h16iu,1,3-propanedisulfonic acid disodium salt,eprodisate disodium usan,1,3-propanedisulfonic acid, disodium salt |
| IUPAC Name | disodium;propane-1,3-disulfonate |
| InChI Key | DKGJFKPIUSHDIT-UHFFFAOYSA-L |
| Molecular Formula | C3H6Na2O6S2 |
4-Methylbenzeneboronic acid neopentyl glycol ester, 99%
CAS: 380481-66-3 Molecular Formula: C12H17BO2 Molecular Weight (g/mol): 204.076 MDL Number: MFCD03788728 InChI Key: ZSPBWRPQSPRISS-UHFFFAOYSA-N Synonym: 5,5-dimethyl-2-p-tolyl-1,3,2-dioxaborinane,4-methylbenzeneboronic acid neopentyl glycol ester,5,5-dimethyl-2-4-methylphenyl-1,3,2-dioxaborinane,amtb973,2-p-tolyl-5,5-dimethyl-1,3,2-dioxaborinane,5,5-dimethyl-2-p-tolyl-1,3,2-dioxaborine,2-4-methylphenyl-5,5-dimethyl-1,3,2-dioxaborinane PubChem CID: 23005406 IUPAC Name: 5,5-dimethyl-2-(4-methylphenyl)-1,3,2-dioxaborinane SMILES: B1(OCC(CO1)(C)C)C2=CC=C(C=C2)C
| PubChem CID | 23005406 |
|---|---|
| CAS | 380481-66-3 |
| Molecular Weight (g/mol) | 204.076 |
| MDL Number | MFCD03788728 |
| SMILES | B1(OCC(CO1)(C)C)C2=CC=C(C=C2)C |
| Synonym | 5,5-dimethyl-2-p-tolyl-1,3,2-dioxaborinane,4-methylbenzeneboronic acid neopentyl glycol ester,5,5-dimethyl-2-4-methylphenyl-1,3,2-dioxaborinane,amtb973,2-p-tolyl-5,5-dimethyl-1,3,2-dioxaborinane,5,5-dimethyl-2-p-tolyl-1,3,2-dioxaborine,2-4-methylphenyl-5,5-dimethyl-1,3,2-dioxaborinane |
| IUPAC Name | 5,5-dimethyl-2-(4-methylphenyl)-1,3,2-dioxaborinane |
| InChI Key | ZSPBWRPQSPRISS-UHFFFAOYSA-N |
| Molecular Formula | C12H17BO2 |
Propargyl p-toluenesulfonate, 97%
CAS: 6165-76-0 Molecular Formula: C10H10O3S Molecular Weight (g/mol): 210.247 MDL Number: MFCD00078365 InChI Key: LMBVCSFXFFROTA-UHFFFAOYSA-N Synonym: propargyl p-toluenesulfonate,propargyl tosylate,prop-2-yn-1-yl 4-methylbenzenesulfonate,p-toluenesulfonic acid, 2-propynyl ester,2-propyn-1-ol, 4-methylbenzenesulfonate,ccris 9146,p-toluenesulfonic acid propargyl ester,propargylp-toluenesulfonate,propargyl p-toluene sulfonate,acmc-209mv7 PubChem CID: 22547 IUPAC Name: prop-2-ynyl 4-methylbenzenesulfonate SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCC#C
| PubChem CID | 22547 |
|---|---|
| CAS | 6165-76-0 |
| Molecular Weight (g/mol) | 210.247 |
| MDL Number | MFCD00078365 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OCC#C |
| Synonym | propargyl p-toluenesulfonate,propargyl tosylate,prop-2-yn-1-yl 4-methylbenzenesulfonate,p-toluenesulfonic acid, 2-propynyl ester,2-propyn-1-ol, 4-methylbenzenesulfonate,ccris 9146,p-toluenesulfonic acid propargyl ester,propargylp-toluenesulfonate,propargyl p-toluene sulfonate,acmc-209mv7 |
| IUPAC Name | prop-2-ynyl 4-methylbenzenesulfonate |
| InChI Key | LMBVCSFXFFROTA-UHFFFAOYSA-N |
| Molecular Formula | C10H10O3S |
4-(Cyanoacetyl)morpholine, 98%
CAS: 15029-32-0 Molecular Formula: C7H10N2O2 Molecular Weight (g/mol): 154.169 MDL Number: MFCD00023353 InChI Key: AUZPMUJGZZSMCP-UHFFFAOYSA-N Synonym: 3-morpholino-3-oxopropanenitrile,4-cyanoacetyl morpholine,morpholine, 4-cyanoacetyl,n-cyanoacetylmorpholine,3-morpholin-4-yl-3-oxopropanenitrile,4-cyanoacetylmorpholine,3-morpholin-4-yl-3-oxo-propionitrile,3-4-morpholinyl-3-oxopropanenitrile,morpholinocarbonyl acetonitrile,4-morpholinepropanenitrile, .beta.-oxo PubChem CID: 229279 IUPAC Name: 3-morpholin-4-yl-3-oxopropanenitrile SMILES: C1COCCN1C(=O)CC#N
| PubChem CID | 229279 |
|---|---|
| CAS | 15029-32-0 |
| Molecular Weight (g/mol) | 154.169 |
| MDL Number | MFCD00023353 |
| SMILES | C1COCCN1C(=O)CC#N |
| Synonym | 3-morpholino-3-oxopropanenitrile,4-cyanoacetyl morpholine,morpholine, 4-cyanoacetyl,n-cyanoacetylmorpholine,3-morpholin-4-yl-3-oxopropanenitrile,4-cyanoacetylmorpholine,3-morpholin-4-yl-3-oxo-propionitrile,3-4-morpholinyl-3-oxopropanenitrile,morpholinocarbonyl acetonitrile,4-morpholinepropanenitrile, .beta.-oxo |
| IUPAC Name | 3-morpholin-4-yl-3-oxopropanenitrile |
| InChI Key | AUZPMUJGZZSMCP-UHFFFAOYSA-N |
| Molecular Formula | C7H10N2O2 |
Methyl dimethoxyacetate, 96%
CAS: 89-91-8 Molecular Formula: C5H10O4 Molecular Weight (g/mol): 134.131 MDL Number: MFCD00008484 InChI Key: NZTCVGHPDWAALP-UHFFFAOYSA-N Synonym: methyl dimethoxyacetate,acetic acid, dimethoxy-, methyl ester,dimethoxyacetic acid methyl ester,glyoxylic acid methyl ester dimethyl acetal,acetic acid, 2,2-dimethoxy-, methyl ester,glyoxylic acid, methyl ester, 2-dimethyl acetal,zlchem 519,acmc-209r3k,ksc490c4f,methyl 2,2-dimethoxyethanoate PubChem CID: 66647 IUPAC Name: methyl 2,2-dimethoxyacetate SMILES: COC(C(=O)OC)OC
| PubChem CID | 66647 |
|---|---|
| CAS | 89-91-8 |
| Molecular Weight (g/mol) | 134.131 |
| MDL Number | MFCD00008484 |
| SMILES | COC(C(=O)OC)OC |
| Synonym | methyl dimethoxyacetate,acetic acid, dimethoxy-, methyl ester,dimethoxyacetic acid methyl ester,glyoxylic acid methyl ester dimethyl acetal,acetic acid, 2,2-dimethoxy-, methyl ester,glyoxylic acid, methyl ester, 2-dimethyl acetal,zlchem 519,acmc-209r3k,ksc490c4f,methyl 2,2-dimethoxyethanoate |
| IUPAC Name | methyl 2,2-dimethoxyacetate |
| InChI Key | NZTCVGHPDWAALP-UHFFFAOYSA-N |
| Molecular Formula | C5H10O4 |
S-Methyl thioacetate, 98+%
CAS: 1534-08-3 Molecular Formula: C3H6OS Molecular Weight (g/mol): 90.14 MDL Number: MFCD00014989 InChI Key: OATSQCXMYKYFQO-UHFFFAOYSA-N Synonym: s-methyl thioacetate,methylthioacetate,ethanethioic acid, s-methyl ester,methanethiol acetate,thioacetic acid s-methyl ester,methyl thiolacetate,methyl ethanethioate,unii-pf2d4mwx79,ch3c o sch3,acetic acid, thio-, s-methyl ester PubChem CID: 73750 ChEBI: CHEBI:51280 IUPAC Name: S-methyl ethanethioate SMILES: CC(=O)SC
| PubChem CID | 73750 |
|---|---|
| CAS | 1534-08-3 |
| Molecular Weight (g/mol) | 90.14 |
| ChEBI | CHEBI:51280 |
| MDL Number | MFCD00014989 |
| SMILES | CC(=O)SC |
| Synonym | s-methyl thioacetate,methylthioacetate,ethanethioic acid, s-methyl ester,methanethiol acetate,thioacetic acid s-methyl ester,methyl thiolacetate,methyl ethanethioate,unii-pf2d4mwx79,ch3c o sch3,acetic acid, thio-, s-methyl ester |
| IUPAC Name | S-methyl ethanethioate |
| InChI Key | OATSQCXMYKYFQO-UHFFFAOYSA-N |
| Molecular Formula | C3H6OS |
Methyl Acetate, Technical, Approx. 75%, Spectrum™ Chemical
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CAS: 79-20-9
| CAS | 79-20-9 |
|---|