Organic acids and derivatives
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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 |
trans-1-Octenylboronic acid pinacol ester, 97%, Thermo Scientific Chemicals
CAS: 83947-55-1 Molecular Formula: C14H27BO2 Molecular Weight (g/mol): 238.178 MDL Number: MFCD03453667 InChI Key: KQTOSGTXAFJZSJ-VAWYXSNFSA-N Synonym: trans-4,4,5,5-tetramethyl-2-oct-1-enyl-1,3,2-dioxaborolane,1-octenylboronic acid pinacol ester,1-octen-1-ylboronic acid, pinacol ester,trans-1-octenylboronic acid pinacol ester,trans-4,4,5,5-tetramethyl-2-1-octenyl-1,3,2-dioxaborolane,e-1-octenylboronic acid pinacol ester,trans-1-octen-1-ylboronic acid pinacol ester,trans-1-oct-1-en-1-yl boronic acid, pinacol ester,trans-4,4,5,5-tetramethyl-2-oct-1-en-1-yl-1,3,2-dioxaborolane PubChem CID: 5706555 IUPAC Name: 4,4,5,5-tetramethyl-2-[(E)-oct-1-enyl]-1,3,2-dioxaborolane SMILES: B1(OC(C(O1)(C)C)(C)C)C=CCCCCCC
| PubChem CID | 5706555 |
|---|---|
| CAS | 83947-55-1 |
| Molecular Weight (g/mol) | 238.178 |
| MDL Number | MFCD03453667 |
| SMILES | B1(OC(C(O1)(C)C)(C)C)C=CCCCCCC |
| Synonym | trans-4,4,5,5-tetramethyl-2-oct-1-enyl-1,3,2-dioxaborolane,1-octenylboronic acid pinacol ester,1-octen-1-ylboronic acid, pinacol ester,trans-1-octenylboronic acid pinacol ester,trans-4,4,5,5-tetramethyl-2-1-octenyl-1,3,2-dioxaborolane,e-1-octenylboronic acid pinacol ester,trans-1-octen-1-ylboronic acid pinacol ester,trans-1-oct-1-en-1-yl boronic acid, pinacol ester,trans-4,4,5,5-tetramethyl-2-oct-1-en-1-yl-1,3,2-dioxaborolane |
| IUPAC Name | 4,4,5,5-tetramethyl-2-[(E)-oct-1-enyl]-1,3,2-dioxaborolane |
| InChI Key | KQTOSGTXAFJZSJ-VAWYXSNFSA-N |
| Molecular Formula | C14H27BO2 |
Bismuth(III) trifluoromethanesulfonate, 99%
CAS: 88189-03-1 Molecular Formula: C3BiF9O9S3 Molecular Weight (g/mol): 656.17 MDL Number: MFCD02093669 InChI Key: NYENCOMLZDQKNH-UHFFFAOYSA-K Synonym: bismuth iii trifluoromethanesulfonate,bismuth triflate,bismuth trifluoromethanesulfonate,bismuth 3+ triflate,bismuth triflate mi,bismuth 3+ trifluoromethanesulfonate,bismuth tris trifluoromethanesulfonate,bismuth iii triflate,bismuth 3+ ion tritriflate PubChem CID: 9917655 IUPAC Name: bismuth;trifluoromethanesulfonate SMILES: C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Bi+3]
| PubChem CID | 9917655 |
|---|---|
| CAS | 88189-03-1 |
| Molecular Weight (g/mol) | 656.17 |
| MDL Number | MFCD02093669 |
| SMILES | C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Bi+3] |
| Synonym | bismuth iii trifluoromethanesulfonate,bismuth triflate,bismuth trifluoromethanesulfonate,bismuth 3+ triflate,bismuth triflate mi,bismuth 3+ trifluoromethanesulfonate,bismuth tris trifluoromethanesulfonate,bismuth iii triflate,bismuth 3+ ion tritriflate |
| IUPAC Name | bismuth;trifluoromethanesulfonate |
| InChI Key | NYENCOMLZDQKNH-UHFFFAOYSA-K |
| Molecular Formula | C3BiF9O9S3 |
Samarium(III) trifluoromethanesulfonate, 98%
CAS: 52093-28-4 Molecular Formula: C3F9O9S3Sm Molecular Weight (g/mol): 597.55 MDL Number: MFCD00192431 InChI Key: DDCWGUIPLGMBPO-UHFFFAOYSA-K Synonym: samarium iii trifluoromethanesulfonate,samarium triflate,samarium iii triflate,samarium trifluoromethanesulfonate,trifluoromethanesulfonic acid samarium iii salt,samarium iii trifluoromethanesulfonate 97+%,sm otf 3,3cf3o3s.sm,samarium 3+ tritriflate PubChem CID: 10145316 IUPAC Name: samarium(3+);trifluoromethanesulfonate SMILES: [Sm+3].[O-]S(=O)(=O)C(F)(F)F.[O-]S(=O)(=O)C(F)(F)F.[O-]S(=O)(=O)C(F)(F)F
| PubChem CID | 10145316 |
|---|---|
| CAS | 52093-28-4 |
| Molecular Weight (g/mol) | 597.55 |
| MDL Number | MFCD00192431 |
| SMILES | [Sm+3].[O-]S(=O)(=O)C(F)(F)F.[O-]S(=O)(=O)C(F)(F)F.[O-]S(=O)(=O)C(F)(F)F |
| Synonym | samarium iii trifluoromethanesulfonate,samarium triflate,samarium iii triflate,samarium trifluoromethanesulfonate,trifluoromethanesulfonic acid samarium iii salt,samarium iii trifluoromethanesulfonate 97+%,sm otf 3,3cf3o3s.sm,samarium 3+ tritriflate |
| IUPAC Name | samarium(3+);trifluoromethanesulfonate |
| InChI Key | DDCWGUIPLGMBPO-UHFFFAOYSA-K |
| Molecular Formula | C3F9O9S3Sm |
5-Bromopyridine-3-boronic acid, tech. 85%, Thermo Scientific Chemicals
CAS: 452972-09-7 Molecular Formula: C5H5BBrNO2 Molecular Weight (g/mol): 201.81 MDL Number: MFCD02685634 InChI Key: ICCGFOKNFZWCTJ-UHFFFAOYSA-N Synonym: 5-bromopyridine-3-boronic acid,5-bromopyridin-3-yl boronic acid,3-bromopyridine-5-boronic acid,3-bromo-5-pyridineboronic acid,3-bromopyridyl-5-boronic acid,5-bromo-3-pyridyl boronic acid,3-bromo-5-pyridylboronic acid,boronic acid, 5-bromo-3-pyridinyl,5-bromopyridine-3-boronicacid,pubchem5305 PubChem CID: 3814811 IUPAC Name: (5-bromopyridin-3-yl)boronic acid SMILES: OB(O)C1=CN=CC(Br)=C1
| PubChem CID | 3814811 |
|---|---|
| CAS | 452972-09-7 |
| Molecular Weight (g/mol) | 201.81 |
| MDL Number | MFCD02685634 |
| SMILES | OB(O)C1=CN=CC(Br)=C1 |
| Synonym | 5-bromopyridine-3-boronic acid,5-bromopyridin-3-yl boronic acid,3-bromopyridine-5-boronic acid,3-bromo-5-pyridineboronic acid,3-bromopyridyl-5-boronic acid,5-bromo-3-pyridyl boronic acid,3-bromo-5-pyridylboronic acid,boronic acid, 5-bromo-3-pyridinyl,5-bromopyridine-3-boronicacid,pubchem5305 |
| IUPAC Name | (5-bromopyridin-3-yl)boronic acid |
| InChI Key | ICCGFOKNFZWCTJ-UHFFFAOYSA-N |
| Molecular Formula | C5H5BBrNO2 |
Methyl methoxyacetate, 99%
CAS: 6290-49-9 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.11 MDL Number: MFCD00008451 InChI Key: QRMHDGWGLNLHMN-UHFFFAOYSA-N Synonym: methyl methoxyacetate,acetic acid, methoxy-, methyl ester,methoxyacetic acid methyl ester,methyl-2-methoxyacetate,methoxyacetic acid, methyl ester,acetic acid, 2-methoxy-, methyl ester,unii-n960nq69lf,methoxy acetic acid methyl ester,methyl metoxyacetate,methyl methoxylacetate PubChem CID: 80507 ChEBI: CHEBI:34841 IUPAC Name: methyl 2-methoxyacetate SMILES: COCC(=O)OC
| PubChem CID | 80507 |
|---|---|
| CAS | 6290-49-9 |
| Molecular Weight (g/mol) | 104.11 |
| ChEBI | CHEBI:34841 |
| MDL Number | MFCD00008451 |
| SMILES | COCC(=O)OC |
| Synonym | methyl methoxyacetate,acetic acid, methoxy-, methyl ester,methoxyacetic acid methyl ester,methyl-2-methoxyacetate,methoxyacetic acid, methyl ester,acetic acid, 2-methoxy-, methyl ester,unii-n960nq69lf,methoxy acetic acid methyl ester,methyl metoxyacetate,methyl methoxylacetate |
| IUPAC Name | methyl 2-methoxyacetate |
| InChI Key | QRMHDGWGLNLHMN-UHFFFAOYSA-N |
| Molecular Formula | C4H8O3 |
Methyl DL-lactate, 99%
CAS: 547-64-8 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.105 MDL Number: MFCD00066367 InChI Key: LPEKGGXMPWTOCB-UHFFFAOYSA-N Synonym: methyl lactate,dl-methyl lactate,methyl dl-lactate,lactic acid methyl ester,methyl 2-hydroxypropionate,lactic acid, methyl ester,+--methyl lactate,propanoic acid, 2-hydroxy-, methyl ester,methyl alpha-hydroxypropionate,methyl-lactate PubChem CID: 11040 ChEBI: CHEBI:83221 IUPAC Name: methyl 2-hydroxypropanoate SMILES: CC(C(=O)OC)O
| PubChem CID | 11040 |
|---|---|
| CAS | 547-64-8 |
| Molecular Weight (g/mol) | 104.105 |
| ChEBI | CHEBI:83221 |
| MDL Number | MFCD00066367 |
| SMILES | CC(C(=O)OC)O |
| Synonym | methyl lactate,dl-methyl lactate,methyl dl-lactate,lactic acid methyl ester,methyl 2-hydroxypropionate,lactic acid, methyl ester,+--methyl lactate,propanoic acid, 2-hydroxy-, methyl ester,methyl alpha-hydroxypropionate,methyl-lactate |
| IUPAC Name | methyl 2-hydroxypropanoate |
| InChI Key | LPEKGGXMPWTOCB-UHFFFAOYSA-N |
| Molecular Formula | C4H8O3 |
Lithium isobutyrate, 98+%
CAS: 25179-23-1 Molecular Formula: C4H7LiO2 Molecular Weight (g/mol): 94.038 MDL Number: MFCD00210622 InChI Key: IIDVGIFOWJJSIJ-UHFFFAOYSA-M Synonym: lithium isobutyrate,lithium 2-methylpropanoate,acmc-1ccd2,isobutyric acid lithium salt,lithium 1+ isobutyrate,lithium 1+ ion isobutyrate PubChem CID: 23665557 IUPAC Name: lithium;2-methylpropanoate SMILES: [Li+].CC(C)C(=O)[O-]
| PubChem CID | 23665557 |
|---|---|
| CAS | 25179-23-1 |
| Molecular Weight (g/mol) | 94.038 |
| MDL Number | MFCD00210622 |
| SMILES | [Li+].CC(C)C(=O)[O-] |
| Synonym | lithium isobutyrate,lithium 2-methylpropanoate,acmc-1ccd2,isobutyric acid lithium salt,lithium 1+ isobutyrate,lithium 1+ ion isobutyrate |
| IUPAC Name | lithium;2-methylpropanoate |
| InChI Key | IIDVGIFOWJJSIJ-UHFFFAOYSA-M |
| Molecular Formula | C4H7LiO2 |
3-Chloro-4-cyanobenzeneboronic acid, 96%
CAS: 1008415-02-8 Molecular Formula: C7H5BClNO2 Molecular Weight (g/mol): 181.382 InChI Key: QCJTUOIMDNJEHR-UHFFFAOYSA-N Synonym: 3-chloro-4-cyanophenyl boronic acid,boronic acid, b-3-chloro-4-cyanophenyl,acmc-2097sr,3-chloro-4-cyanophenyl boronicacid PubChem CID: 46738932 IUPAC Name: (3-chloro-4-cyanophenyl)boronic acid SMILES: B(C1=CC(=C(C=C1)C#N)Cl)(O)O
| PubChem CID | 46738932 |
|---|---|
| CAS | 1008415-02-8 |
| Molecular Weight (g/mol) | 181.382 |
| SMILES | B(C1=CC(=C(C=C1)C#N)Cl)(O)O |
| Synonym | 3-chloro-4-cyanophenyl boronic acid,boronic acid, b-3-chloro-4-cyanophenyl,acmc-2097sr,3-chloro-4-cyanophenyl boronicacid |
| IUPAC Name | (3-chloro-4-cyanophenyl)boronic acid |
| InChI Key | QCJTUOIMDNJEHR-UHFFFAOYSA-N |
| Molecular Formula | C7H5BClNO2 |
3-(2-Methoxycarbonylethyl)benzeneboronic acid, 97%
CAS: 833472-82-5 Molecular Formula: C10H13BO4 Molecular Weight (g/mol): 208.02 MDL Number: MFCD04115648 InChI Key: IPXZIWCEVNDHFD-UHFFFAOYSA-N Synonym: 3-2-methoxycarbonylethyl phenylboronic acid,methyl 3-3-boronophenyl propionate,3-3-methoxy-3-oxopropyl phenyl boronic acid,3-3-methoxy-3-oxopropyl phenylboronic acid,3-2-methoxycarbonylethyl phenyl boronic acid,acmc-209prx,benzenepropanoic acid,3-borono-, 1-methyl ester PubChem CID: 4993880 IUPAC Name: [3-(3-methoxy-3-oxopropyl)phenyl]boronic acid SMILES: COC(=O)CCC1=CC=CC(=C1)B(O)O
| PubChem CID | 4993880 |
|---|---|
| CAS | 833472-82-5 |
| Molecular Weight (g/mol) | 208.02 |
| MDL Number | MFCD04115648 |
| SMILES | COC(=O)CCC1=CC=CC(=C1)B(O)O |
| Synonym | 3-2-methoxycarbonylethyl phenylboronic acid,methyl 3-3-boronophenyl propionate,3-3-methoxy-3-oxopropyl phenyl boronic acid,3-3-methoxy-3-oxopropyl phenylboronic acid,3-2-methoxycarbonylethyl phenyl boronic acid,acmc-209prx,benzenepropanoic acid,3-borono-, 1-methyl ester |
| IUPAC Name | [3-(3-methoxy-3-oxopropyl)phenyl]boronic acid |
| InChI Key | IPXZIWCEVNDHFD-UHFFFAOYSA-N |
| Molecular Formula | C10H13BO4 |
Benzo[b]furan-2-boronic acid, 98%
CAS: 98437-24-2 Molecular Formula: C8H7BO3 Molecular Weight (g/mol): 161.95 MDL Number: MFCD00236019 InChI Key: PKRRNTJIHGOMRC-UHFFFAOYSA-N Synonym: benzofuran-2-boronic acid,benzo b furan-2-boronic acid,benzofuran-2-ylboronic acid,2-benzofuranboronic acid,2-benzofuranylboronic acid,2,3-benzo b furan-2-boronic acid,2-boronobenzo b furan,1-benzofuran-2-yl boronic acid,1-benzofuran-2-boronic acid PubChem CID: 2776266 IUPAC Name: 1-benzofuran-2-ylboronic acid SMILES: OB(O)C1=CC2=CC=CC=C2O1
| PubChem CID | 2776266 |
|---|---|
| CAS | 98437-24-2 |
| Molecular Weight (g/mol) | 161.95 |
| MDL Number | MFCD00236019 |
| SMILES | OB(O)C1=CC2=CC=CC=C2O1 |
| Synonym | benzofuran-2-boronic acid,benzo b furan-2-boronic acid,benzofuran-2-ylboronic acid,2-benzofuranboronic acid,2-benzofuranylboronic acid,2,3-benzo b furan-2-boronic acid,2-boronobenzo b furan,1-benzofuran-2-yl boronic acid,1-benzofuran-2-boronic acid |
| IUPAC Name | 1-benzofuran-2-ylboronic acid |
| InChI Key | PKRRNTJIHGOMRC-UHFFFAOYSA-N |
| Molecular Formula | C8H7BO3 |
Isobutylboronic acid, 97%
CAS: 84110-40-7 Molecular Formula: C4H11BO2 Molecular Weight (g/mol): 101.94 MDL Number: MFCD00134156 InChI Key: ZAZPDOYUCVFPOI-UHFFFAOYSA-N Synonym: isobutylboronic acid,isobutaneboronic acid,2-methylpropyl boronic acid,1-isobutaneboronic acid,2-methylpropaneboronic acid,2-methylprop-1-ylboronic acid,unii-khx76h7jhz,khx76h7jhz,2-methyl-1-propylboronic acid,2-methyl-1-propaneboronic acid PubChem CID: 2734395 IUPAC Name: 2-methylpropylboronic acid SMILES: CC(C)CB(O)O
| PubChem CID | 2734395 |
|---|---|
| CAS | 84110-40-7 |
| Molecular Weight (g/mol) | 101.94 |
| MDL Number | MFCD00134156 |
| SMILES | CC(C)CB(O)O |
| Synonym | isobutylboronic acid,isobutaneboronic acid,2-methylpropyl boronic acid,1-isobutaneboronic acid,2-methylpropaneboronic acid,2-methylprop-1-ylboronic acid,unii-khx76h7jhz,khx76h7jhz,2-methyl-1-propylboronic acid,2-methyl-1-propaneboronic acid |
| IUPAC Name | 2-methylpropylboronic acid |
| InChI Key | ZAZPDOYUCVFPOI-UHFFFAOYSA-N |
| Molecular Formula | C4H11BO2 |
2,6-Dimethoxybenzeneboronic acid, 97+%
CAS: 23112-96-1 Molecular Formula: C8H11BO4 Molecular Weight (g/mol): 181.982 MDL Number: MFCD01318987 InChI Key: BKWVXPCYDRURMK-UHFFFAOYSA-N Synonym: 2,6-dimethoxyphenyl boronic acid,2,6-dimethoxyphenylboronicacid,2,6-dimethoxybenzeneboronic acid,2,6-dimethoxyphenyl-boronic acid,2,6-dimethoxyphenyl boranediol,boronic acid, 2,6-dimethoxyphenyl,pubchem1825,acmc-1clhv,ksc201q0f,2,6-dimethoxy-phenylboronic acid PubChem CID: 2734343 IUPAC Name: (2,6-dimethoxyphenyl)boronic acid SMILES: B(C1=C(C=CC=C1OC)OC)(O)O
| PubChem CID | 2734343 |
|---|---|
| CAS | 23112-96-1 |
| Molecular Weight (g/mol) | 181.982 |
| MDL Number | MFCD01318987 |
| SMILES | B(C1=C(C=CC=C1OC)OC)(O)O |
| Synonym | 2,6-dimethoxyphenyl boronic acid,2,6-dimethoxyphenylboronicacid,2,6-dimethoxybenzeneboronic acid,2,6-dimethoxyphenyl-boronic acid,2,6-dimethoxyphenyl boranediol,boronic acid, 2,6-dimethoxyphenyl,pubchem1825,acmc-1clhv,ksc201q0f,2,6-dimethoxy-phenylboronic acid |
| IUPAC Name | (2,6-dimethoxyphenyl)boronic acid |
| InChI Key | BKWVXPCYDRURMK-UHFFFAOYSA-N |
| Molecular Formula | C8H11BO4 |
2,2,2-Trifluoroethyl p-toluenesulfonate, 98+%
CAS: 433-06-7 Molecular Formula: C9H9F3O3S Molecular Weight (g/mol): 254.223 MDL Number: MFCD00000443 InChI Key: IGKCQDUYZULGBM-UHFFFAOYSA-N Synonym: 2,2,2-trifluoroethyl p-toluenesulfonate,2,2,2-trifluoroethyl tosylate,trifluoroethanol tosylate,trifluorethyltosylate,2,2,2-trifluoroethyl-p-toluenesulfonate,ethanol, 2,2,2-trifluoro-, 4-methylbenzenesulfonate,2,2,2-trifluoroethyl p-toluenesulphonate,ethanol, 2,2,2-trifluoro-, p-toluenesulfonate,2,2,2-trifluoroethyl 4-methylbenzene-1-sulfonate,ethanol, 2,2,2-trifluoro-, 1-4-methylbenzenesulfonate PubChem CID: 67942 IUPAC Name: 2,2,2-trifluoroethyl 4-methylbenzenesulfonate SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCC(F)(F)F
| PubChem CID | 67942 |
|---|---|
| CAS | 433-06-7 |
| Molecular Weight (g/mol) | 254.223 |
| MDL Number | MFCD00000443 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OCC(F)(F)F |
| Synonym | 2,2,2-trifluoroethyl p-toluenesulfonate,2,2,2-trifluoroethyl tosylate,trifluoroethanol tosylate,trifluorethyltosylate,2,2,2-trifluoroethyl-p-toluenesulfonate,ethanol, 2,2,2-trifluoro-, 4-methylbenzenesulfonate,2,2,2-trifluoroethyl p-toluenesulphonate,ethanol, 2,2,2-trifluoro-, p-toluenesulfonate,2,2,2-trifluoroethyl 4-methylbenzene-1-sulfonate,ethanol, 2,2,2-trifluoro-, 1-4-methylbenzenesulfonate |
| IUPAC Name | 2,2,2-trifluoroethyl 4-methylbenzenesulfonate |
| InChI Key | IGKCQDUYZULGBM-UHFFFAOYSA-N |
| Molecular Formula | C9H9F3O3S |