Organic acids and derivatives
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Cyclopropylboronic acid pinacol ester, 95%
CAS: 126689-01-8 Molecular Formula: C9H17BO2 Molecular Weight (g/mol): 168.04 MDL Number: MFCD05663847 InChI Key: XGBMQBPLWXTEPM-UHFFFAOYSA-N Synonym: cyclopropylboronic acid pinacol ester,cyclopropylboronic acid, pinacol ester,4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl cyclopropane,1,3,2-dioxaborolane, 2-cyclopropyl-4,4,5,5-tetramethyl,2-cyclopropyl-4,4,5,5-tetramethyl-1,3,2 dioxaborolane,2-cyclopropyl-4,4,5,5-tetramethyl-1,3,2-dioxaborol,cypbe,pubchem4015,pubchem7931,acmc-209bbh PubChem CID: 2758015 IUPAC Name: 2-cyclopropyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: CC1(C)OB(OC1(C)C)C1CC1
| PubChem CID | 2758015 |
|---|---|
| CAS | 126689-01-8 |
| Molecular Weight (g/mol) | 168.04 |
| MDL Number | MFCD05663847 |
| SMILES | CC1(C)OB(OC1(C)C)C1CC1 |
| Synonym | cyclopropylboronic acid pinacol ester,cyclopropylboronic acid, pinacol ester,4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl cyclopropane,1,3,2-dioxaborolane, 2-cyclopropyl-4,4,5,5-tetramethyl,2-cyclopropyl-4,4,5,5-tetramethyl-1,3,2 dioxaborolane,2-cyclopropyl-4,4,5,5-tetramethyl-1,3,2-dioxaborol,cypbe,pubchem4015,pubchem7931,acmc-209bbh |
| IUPAC Name | 2-cyclopropyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| InChI Key | XGBMQBPLWXTEPM-UHFFFAOYSA-N |
| Molecular Formula | C9H17BO2 |
Di-tert-butyl hydrazodiformate, 97%
CAS: 16466-61-8 Molecular Formula: C10H20N2O4 Molecular Weight (g/mol): 232.28 InChI Key: TYSZETYVESRFNT-UHFFFAOYSA-N Synonym: di-tert-butyl hydrazodicarboxylate,di-tert-butyl hydrazine-1,2-dicarboxylate,di-tert-butyl hydrazodiformate,di-tert-butyl bicarbamate,n,n'-di-boc-hydrazine,n,n'-bis tert-butoxycarbonyl hydrazine,di-tert-butyl-1,2-hydrazodicarboxylate,1,2-hydrazinedicarboxylic acid, bis 1,1-dimethylethyl ester,tert-butyl n-2-methylpropan-2-yl oxycarbonylamino carbamate,n'-tert-butoxy carbonyl tert-butoxy carbohydrazide PubChem CID: 85431 IUPAC Name: tert-butyl N-[(2-methylpropan-2-yl)oxycarbonylamino]carbamate SMILES: CC(C)(C)OC(=O)NNC(=O)OC(C)(C)C
| PubChem CID | 85431 |
|---|---|
| CAS | 16466-61-8 |
| Molecular Weight (g/mol) | 232.28 |
| SMILES | CC(C)(C)OC(=O)NNC(=O)OC(C)(C)C |
| Synonym | di-tert-butyl hydrazodicarboxylate,di-tert-butyl hydrazine-1,2-dicarboxylate,di-tert-butyl hydrazodiformate,di-tert-butyl bicarbamate,n,n'-di-boc-hydrazine,n,n'-bis tert-butoxycarbonyl hydrazine,di-tert-butyl-1,2-hydrazodicarboxylate,1,2-hydrazinedicarboxylic acid, bis 1,1-dimethylethyl ester,tert-butyl n-2-methylpropan-2-yl oxycarbonylamino carbamate,n'-tert-butoxy carbonyl tert-butoxy carbohydrazide |
| IUPAC Name | tert-butyl N-[(2-methylpropan-2-yl)oxycarbonylamino]carbamate |
| InChI Key | TYSZETYVESRFNT-UHFFFAOYSA-N |
| Molecular Formula | C10H20N2O4 |
1,3-Bis(hydroxymethyl)urea, tech. 90%
CAS: 140-95-4 Molecular Formula: C3H8N2O3 Molecular Weight (g/mol): 120.11 MDL Number: MFCD00014414 InChI Key: QUBQYFYWUJJAAK-UHFFFAOYSA-N Synonym: 1,3-bis hydroxymethyl urea,dimethylolurea,oxymethurea,n,n'-dimethylolurea,methural,carbamol,caurite,metural,urofix,protesine dmu PubChem CID: 8827 IUPAC Name: 1,3-bis(hydroxymethyl)urea SMILES: OCNC(=O)NCO
| PubChem CID | 8827 |
|---|---|
| CAS | 140-95-4 |
| Molecular Weight (g/mol) | 120.11 |
| MDL Number | MFCD00014414 |
| SMILES | OCNC(=O)NCO |
| Synonym | 1,3-bis hydroxymethyl urea,dimethylolurea,oxymethurea,n,n'-dimethylolurea,methural,carbamol,caurite,metural,urofix,protesine dmu |
| IUPAC Name | 1,3-bis(hydroxymethyl)urea |
| InChI Key | QUBQYFYWUJJAAK-UHFFFAOYSA-N |
| Molecular Formula | C3H8N2O3 |
Bicyclo[2.2.2]oct-7-ene-2,3,5,6-tetracarboxylic dianhydride, 97%
CAS: 1719-83-1 Molecular Formula: C12H8O6 Molecular Weight (g/mol): 248.19 MDL Number: MFCD00082228 InChI Key: XLOGCGOPKPCECW-UHFFFAOYSA-N Synonym: bicyclo 2.2.2 oct-7-ene-2,3,5,6-tetracarboxylic dianhydride,4,4a,8,8a-tetrahydro-4,8-ethenobenzo 1,2-c:4,5-c' difuran-1,3,5,7 3ah,7ah-tetraone,bicyclo 2.2.2 oct-7-ene-2,3,5,6-tetracarboxylic acid dianhydride,4,8-etheno-1h,3h-benzo 1,2-c:4,5-c' difuran-1,3,5,7-tetrone, 3a,4,4a,7a,8,8a-hexahydro,bicyclo 2.2.2-7-octene-2,3,5,6-tetracarboxylic dianhydride,bicyclo 2.2.2-7-octene-2,3,5,6-tetracarboxylic acid dianhydride,4,10-dioxatetracyclo 5.5.2.0<2,6>.0<8,12> tetradec-13-ene-3,5,9,11-tetraone,4,10-dioxatetracyclo 5.5.2.0 2 ,?.0?, 1 2 tetradec-13-ene-3,5,9,11-tetrone,bicyclo 2.2.2 oct-7-ene-2,3:5,6-tetracarboxylic dianhydride,4,4a,8,8a-tetrahydro-4,8-ethenobenzo 1,2-c PubChem CID: 102679 SMILES: C1=CC2C3C(C1C4C2C(=O)OC4=O)C(=O)OC3=O
| PubChem CID | 102679 |
|---|---|
| CAS | 1719-83-1 |
| Molecular Weight (g/mol) | 248.19 |
| MDL Number | MFCD00082228 |
| SMILES | C1=CC2C3C(C1C4C2C(=O)OC4=O)C(=O)OC3=O |
| Synonym | bicyclo 2.2.2 oct-7-ene-2,3,5,6-tetracarboxylic dianhydride,4,4a,8,8a-tetrahydro-4,8-ethenobenzo 1,2-c:4,5-c' difuran-1,3,5,7 3ah,7ah-tetraone,bicyclo 2.2.2 oct-7-ene-2,3,5,6-tetracarboxylic acid dianhydride,4,8-etheno-1h,3h-benzo 1,2-c:4,5-c' difuran-1,3,5,7-tetrone, 3a,4,4a,7a,8,8a-hexahydro,bicyclo 2.2.2-7-octene-2,3,5,6-tetracarboxylic dianhydride,bicyclo 2.2.2-7-octene-2,3,5,6-tetracarboxylic acid dianhydride,4,10-dioxatetracyclo 5.5.2.0<2,6>.0<8,12> tetradec-13-ene-3,5,9,11-tetraone,4,10-dioxatetracyclo 5.5.2.0 2 ,?.0?, 1 2 tetradec-13-ene-3,5,9,11-tetrone,bicyclo 2.2.2 oct-7-ene-2,3:5,6-tetracarboxylic dianhydride,4,4a,8,8a-tetrahydro-4,8-ethenobenzo 1,2-c |
| InChI Key | XLOGCGOPKPCECW-UHFFFAOYSA-N |
| Molecular Formula | C12H8O6 |
Diphenyl phosphate, 97%
CAS: 838-85-7 Molecular Formula: C12H11O4P Molecular Weight (g/mol): 250.19 MDL Number: MFCD00003033 InChI Key: ASMQGLCHMVWBQR-UHFFFAOYSA-N Synonym: diphenyl phosphate,phosphoric acid, diphenyl ester,phenyl hydrogen phosphate,phenyl phosphate pho 2 ho po,diphenoxyphosphinic acid,phosphoric acid diphenyl ester,diphenylphosphoric acid,phosphoric acid diphenyl,dsstox_cid_28182 PubChem CID: 13282 IUPAC Name: diphenyl hydrogen phosphate SMILES: OP(=O)(OC1=CC=CC=C1)OC1=CC=CC=C1
| PubChem CID | 13282 |
|---|---|
| CAS | 838-85-7 |
| Molecular Weight (g/mol) | 250.19 |
| MDL Number | MFCD00003033 |
| SMILES | OP(=O)(OC1=CC=CC=C1)OC1=CC=CC=C1 |
| Synonym | diphenyl phosphate,phosphoric acid, diphenyl ester,phenyl hydrogen phosphate,phenyl phosphate pho 2 ho po,diphenoxyphosphinic acid,phosphoric acid diphenyl ester,diphenylphosphoric acid,phosphoric acid diphenyl,dsstox_cid_28182 |
| IUPAC Name | diphenyl hydrogen phosphate |
| InChI Key | ASMQGLCHMVWBQR-UHFFFAOYSA-N |
| Molecular Formula | C12H11O4P |
Trifluoromethanesulfonamide, 96%
CAS: 421-85-2 Molecular Formula: CH2F3NO2S Molecular Weight (g/mol): 149.09 MDL Number: MFCD00068714 InChI Key: KAKQVSNHTBLJCH-UHFFFAOYSA-N Synonym: trifluoromethanesulphonamide,trifluoromethane sulfonamide,trifluoromethylsulfonamide,1,1,1-trifluoromethanesulfonamide,chembl67511,methanesulfonamide, 1,1,1-trifluoro,1bcd,trifluoromethyl sulfonamide,triflamide,trifluorometanesulfonamide PubChem CID: 79001 IUPAC Name: trifluoromethanesulfonamide SMILES: NS(=O)(=O)C(F)(F)F
| PubChem CID | 79001 |
|---|---|
| CAS | 421-85-2 |
| Molecular Weight (g/mol) | 149.09 |
| MDL Number | MFCD00068714 |
| SMILES | NS(=O)(=O)C(F)(F)F |
| Synonym | trifluoromethanesulphonamide,trifluoromethane sulfonamide,trifluoromethylsulfonamide,1,1,1-trifluoromethanesulfonamide,chembl67511,methanesulfonamide, 1,1,1-trifluoro,1bcd,trifluoromethyl sulfonamide,triflamide,trifluorometanesulfonamide |
| IUPAC Name | trifluoromethanesulfonamide |
| InChI Key | KAKQVSNHTBLJCH-UHFFFAOYSA-N |
| Molecular Formula | CH2F3NO2S |
EDTA, Sodium Ferric Salt, MP Biomedicals
CAS: 15708-41-5 Molecular Formula: C10H12FeN2NaO8 Molecular Weight (g/mol): 367.047 InChI Key: MKWYFZFMAMBPQK-UHFFFAOYSA-J Synonym: sodium feredetate,edta ferric sodium salt,calmosine,sodium ironedetate,edta iron iii sodium salt,ferisan,sytron,sequestrene nafe,sodium iron edta,ferric sodium edta PubChem CID: 27461 ChEBI: CHEBI:78292 IUPAC Name: sodium;2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate;iron(3+) SMILES: C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Fe+3]
| PubChem CID | 27461 |
|---|---|
| CAS | 15708-41-5 |
| Molecular Weight (g/mol) | 367.047 |
| ChEBI | CHEBI:78292 |
| SMILES | C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Fe+3] |
| Synonym | sodium feredetate,edta ferric sodium salt,calmosine,sodium ironedetate,edta iron iii sodium salt,ferisan,sytron,sequestrene nafe,sodium iron edta,ferric sodium edta |
| IUPAC Name | sodium;2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate;iron(3+) |
| InChI Key | MKWYFZFMAMBPQK-UHFFFAOYSA-J |
| Molecular Formula | C10H12FeN2NaO8 |
3,4-Dihydroxy-3-cyclobutene-1,2-dione, 98+%
CAS: 2892-51-5 Molecular Formula: C4H2O4 Molecular Weight (g/mol): 114.056 MDL Number: MFCD00001334 InChI Key: PWEBUXCTKOWPCW-UHFFFAOYSA-N Synonym: squaric acid,3,4-dihydroxy-3-cyclobutene-1,2-dione,quadratic acid,3-cyclobutene-1,2-dione, 3,4-dihydroxy,quadratsaeure,cyclobutenedione, dihydroxy,1,2-diketo-3,4-dihydroxycyclobutene,dihydroxycyclobutenedione,unii-svr9d0vodw,dihydroxycyclobut-3-ene-1,2-dione PubChem CID: 17913 ChEBI: CHEBI:52141 IUPAC Name: 3,4-dihydroxycyclobut-3-ene-1,2-dione SMILES: C1(=C(C(=O)C1=O)O)O
| PubChem CID | 17913 |
|---|---|
| CAS | 2892-51-5 |
| Molecular Weight (g/mol) | 114.056 |
| ChEBI | CHEBI:52141 |
| MDL Number | MFCD00001334 |
| SMILES | C1(=C(C(=O)C1=O)O)O |
| Synonym | squaric acid,3,4-dihydroxy-3-cyclobutene-1,2-dione,quadratic acid,3-cyclobutene-1,2-dione, 3,4-dihydroxy,quadratsaeure,cyclobutenedione, dihydroxy,1,2-diketo-3,4-dihydroxycyclobutene,dihydroxycyclobutenedione,unii-svr9d0vodw,dihydroxycyclobut-3-ene-1,2-dione |
| IUPAC Name | 3,4-dihydroxycyclobut-3-ene-1,2-dione |
| InChI Key | PWEBUXCTKOWPCW-UHFFFAOYSA-N |
| Molecular Formula | C4H2O4 |
Chlorodifluoroacetic anhydride, 98+%
CAS: 2834-23-3 Molecular Formula: C4Cl2F4O3 Molecular Weight (g/mol): 242.93 MDL Number: MFCD00000774 InChI Key: VBJIFLOSOQGDRZ-UHFFFAOYSA-N Synonym: chlorodifluoroacetic anhydride,acetic acid, chlorodifluoro-, anhydride,acetic acid, 2-chloro-2,2-difluoro-, 1,1'-anhydride,chlorodifluoroacetic anhyride,chlorodifluoroacetic acid anhydride,2-chloro-2,2-difluoroacetic anhydride,2-chloro-2,2-difluoroacetyl 2-chloro-2,2-difluoroacetate PubChem CID: 76074 IUPAC Name: (2-chloro-2,2-difluoroacetyl) 2-chloro-2,2-difluoroacetate SMILES: FC(F)(Cl)C(=O)OC(=O)C(F)(F)Cl
| PubChem CID | 76074 |
|---|---|
| CAS | 2834-23-3 |
| Molecular Weight (g/mol) | 242.93 |
| MDL Number | MFCD00000774 |
| SMILES | FC(F)(Cl)C(=O)OC(=O)C(F)(F)Cl |
| Synonym | chlorodifluoroacetic anhydride,acetic acid, chlorodifluoro-, anhydride,acetic acid, 2-chloro-2,2-difluoro-, 1,1'-anhydride,chlorodifluoroacetic anhyride,chlorodifluoroacetic acid anhydride,2-chloro-2,2-difluoroacetic anhydride,2-chloro-2,2-difluoroacetyl 2-chloro-2,2-difluoroacetate |
| IUPAC Name | (2-chloro-2,2-difluoroacetyl) 2-chloro-2,2-difluoroacetate |
| InChI Key | VBJIFLOSOQGDRZ-UHFFFAOYSA-N |
| Molecular Formula | C4Cl2F4O3 |
4-Cyanophenylacetic acid, 97%
CAS: 5462-71-5 Molecular Formula: C9H7NO2 Molecular Weight (g/mol): 161.16 MDL Number: MFCD06798066 InChI Key: WEBXRQONNWEETE-UHFFFAOYSA-N Synonym: 2-4-cyanophenyl acetic acid,4-cyanophenylacetic acid,4-cyanophenyl acetic acid,benzeneacetic acid, 4-cyano,4-cyano-phenyl-acetic acid,p-cyanophenylacetic acid,4-cyanobenzeneacetic acid,p-cyanophenyl acetic acid,acetic acid, p-cyanophenyl PubChem CID: 79587 IUPAC Name: 2-(4-cyanophenyl)acetic acid SMILES: OC(=O)CC1=CC=C(C=C1)C#N
| PubChem CID | 79587 |
|---|---|
| CAS | 5462-71-5 |
| Molecular Weight (g/mol) | 161.16 |
| MDL Number | MFCD06798066 |
| SMILES | OC(=O)CC1=CC=C(C=C1)C#N |
| Synonym | 2-4-cyanophenyl acetic acid,4-cyanophenylacetic acid,4-cyanophenyl acetic acid,benzeneacetic acid, 4-cyano,4-cyano-phenyl-acetic acid,p-cyanophenylacetic acid,4-cyanobenzeneacetic acid,p-cyanophenyl acetic acid,acetic acid, p-cyanophenyl |
| IUPAC Name | 2-(4-cyanophenyl)acetic acid |
| InChI Key | WEBXRQONNWEETE-UHFFFAOYSA-N |
| Molecular Formula | C9H7NO2 |
Triethyl methanetricarboxylate, 98%
CAS: 6279-86-3 Molecular Formula: C10H16O6 Molecular Weight (g/mol): 232.232 MDL Number: MFCD00009150 InChI Key: AGZPNUZBDCYTBB-UHFFFAOYSA-N Synonym: tricarbethoxymethane,triethylmethanetricarboxylate,methanetricarboxylic acid, triethyl ester,2-ethoxycarbonyl-malonic acid diethyl ester,methanetricarboxylic acid triethyl ester,carboxymalonic acid triethyl ester,diethyl 2-ethoxycarbonyl malonate,diethyl 2-ethoxycarbonyl propane-1,3-dioate,pubchem3106,triethoxycarbonylmethane PubChem CID: 80471 IUPAC Name: triethyl methanetricarboxylate SMILES: CCOC(=O)C(C(=O)OCC)C(=O)OCC
| PubChem CID | 80471 |
|---|---|
| CAS | 6279-86-3 |
| Molecular Weight (g/mol) | 232.232 |
| MDL Number | MFCD00009150 |
| SMILES | CCOC(=O)C(C(=O)OCC)C(=O)OCC |
| Synonym | tricarbethoxymethane,triethylmethanetricarboxylate,methanetricarboxylic acid, triethyl ester,2-ethoxycarbonyl-malonic acid diethyl ester,methanetricarboxylic acid triethyl ester,carboxymalonic acid triethyl ester,diethyl 2-ethoxycarbonyl malonate,diethyl 2-ethoxycarbonyl propane-1,3-dioate,pubchem3106,triethoxycarbonylmethane |
| IUPAC Name | triethyl methanetricarboxylate |
| InChI Key | AGZPNUZBDCYTBB-UHFFFAOYSA-N |
| Molecular Formula | C10H16O6 |
Diethyl 2-bromoethylphosphonate, 97%
CAS: 5324-30-1 Molecular Formula: C6H14BrO3P Molecular Weight (g/mol): 245.05 MDL Number: MFCD00000239 InChI Key: PINITSMLVXAASM-UHFFFAOYSA-N Synonym: diethyl 2-bromoethyl phosphonate,diethyl 2-bromoethylphosphonate,phosphonic acid, 2-bromoethyl-, diethyl ester,2-bromoethyl phosphonic acid diethyl ester,o,o-diethyl 2-bromoethyl phosphonate,diethyl bromoethylphosphonate,diethyl-2-bromoethyl-phosphonate,pinitsmlvxaasm-uhfffaoysa,diethyl-2-bromoethyl phosphonate PubChem CID: 79218 SMILES: CCOP(=O)(CCBr)OCC
| PubChem CID | 79218 |
|---|---|
| CAS | 5324-30-1 |
| Molecular Weight (g/mol) | 245.05 |
| MDL Number | MFCD00000239 |
| SMILES | CCOP(=O)(CCBr)OCC |
| Synonym | diethyl 2-bromoethyl phosphonate,diethyl 2-bromoethylphosphonate,phosphonic acid, 2-bromoethyl-, diethyl ester,2-bromoethyl phosphonic acid diethyl ester,o,o-diethyl 2-bromoethyl phosphonate,diethyl bromoethylphosphonate,diethyl-2-bromoethyl-phosphonate,pinitsmlvxaasm-uhfffaoysa,diethyl-2-bromoethyl phosphonate |
| InChI Key | PINITSMLVXAASM-UHFFFAOYSA-N |
| Molecular Formula | C6H14BrO3P |
2-(Propylthio)pyridine-3-carbonyl chloride, 97%, Thermo Scientific™
CAS: 175135-24-7 Molecular Formula: C9H10ClNOS Molecular Weight (g/mol): 215.70 MDL Number: MFCD00052656 InChI Key: FTEUTJYYROCUBI-UHFFFAOYSA-N Synonym: 2-propylthio pyridine-3-carbonyl chloride,2-propylsulfanyl pyridine-3-carbonyl chloride,2-propylthio nicotinoyl chloride,2-propylthiopyridine-3-carbonyl chloride,3-pyridinecarbonylchloride, 2-propylthio,2-propylthio pyridine-3-carbonylchloride PubChem CID: 2774530 IUPAC Name: 2-propylsulfanylpyridine-3-carbonyl chloride SMILES: CCCSC1=C(C=CC=N1)C(Cl)=O
| PubChem CID | 2774530 |
|---|---|
| CAS | 175135-24-7 |
| Molecular Weight (g/mol) | 215.70 |
| MDL Number | MFCD00052656 |
| SMILES | CCCSC1=C(C=CC=N1)C(Cl)=O |
| Synonym | 2-propylthio pyridine-3-carbonyl chloride,2-propylsulfanyl pyridine-3-carbonyl chloride,2-propylthio nicotinoyl chloride,2-propylthiopyridine-3-carbonyl chloride,3-pyridinecarbonylchloride, 2-propylthio,2-propylthio pyridine-3-carbonylchloride |
| IUPAC Name | 2-propylsulfanylpyridine-3-carbonyl chloride |
| InChI Key | FTEUTJYYROCUBI-UHFFFAOYSA-N |
| Molecular Formula | C9H10ClNOS |