Organic acids and derivatives
Filtered Search Results
Diethyl (2-Methylbenzyl)phosphonate 98.0+%, TCI America™
CAS: 62778-16-9 Molecular Formula: C12H19O3P Molecular Weight (g/mol): 242.255 InChI Key: SAVIMLRIKAZZCZ-UHFFFAOYSA-N Synonym: 2-(Diethylphosphonomethyl)toluene, (2-Methylbenzyl)phosphonic Acid Diethyl Ester PubChem CID: 112945 IUPAC Name: 1-(diethoxyphosphorylmethyl)-2-methylbenzene SMILES: CCOP(=O)(CC1=CC=CC=C1C)OCC
| PubChem CID | 112945 |
|---|---|
| CAS | 62778-16-9 |
| Molecular Weight (g/mol) | 242.255 |
| SMILES | CCOP(=O)(CC1=CC=CC=C1C)OCC |
| Synonym | 2-(Diethylphosphonomethyl)toluene, (2-Methylbenzyl)phosphonic Acid Diethyl Ester |
| IUPAC Name | 1-(diethoxyphosphorylmethyl)-2-methylbenzene |
| InChI Key | SAVIMLRIKAZZCZ-UHFFFAOYSA-N |
| Molecular Formula | C12H19O3P |
4-Cyano-3-fluorophenylboronic Acid (contains varying amounts of Anhydride), TCI America™
CAS: 843663-18-3 Molecular Formula: C7H5BFNO2 Molecular Weight (g/mol): 164.93 MDL Number: MFCD03411549 InChI Key: DECWLXUOZUMPBF-UHFFFAOYSA-N PubChem CID: 2783130 IUPAC Name: (4-cyano-3-fluorophenyl)boronic acid SMILES: OB(O)C1=CC(F)=C(C=C1)C#N
| PubChem CID | 2783130 |
|---|---|
| CAS | 843663-18-3 |
| Molecular Weight (g/mol) | 164.93 |
| MDL Number | MFCD03411549 |
| SMILES | OB(O)C1=CC(F)=C(C=C1)C#N |
| IUPAC Name | (4-cyano-3-fluorophenyl)boronic acid |
| InChI Key | DECWLXUOZUMPBF-UHFFFAOYSA-N |
| Molecular Formula | C7H5BFNO2 |
o-Xylylenediphosphonic Acid 97.0+%, TCI America™
CAS: 42104-58-5 Molecular Formula: C8H12O6P2 Molecular Weight (g/mol): 266.126 MDL Number: MFCD22200404 InChI Key: ZCVUWZJGYKGTPG-UHFFFAOYSA-N PubChem CID: 12471823 IUPAC Name: [2-(phosphonomethyl)phenyl]methylphosphonic acid SMILES: C1=CC=C(C(=C1)CP(=O)(O)O)CP(=O)(O)O
| PubChem CID | 12471823 |
|---|---|
| CAS | 42104-58-5 |
| Molecular Weight (g/mol) | 266.126 |
| MDL Number | MFCD22200404 |
| SMILES | C1=CC=C(C(=C1)CP(=O)(O)O)CP(=O)(O)O |
| IUPAC Name | [2-(phosphonomethyl)phenyl]methylphosphonic acid |
| InChI Key | ZCVUWZJGYKGTPG-UHFFFAOYSA-N |
| Molecular Formula | C8H12O6P2 |
Sodium 1-Decanesulfonate 98.0+%, TCI America™
CAS: 13419-61-9 Molecular Formula: C10H21NaO3S Molecular Weight (g/mol): 244.325 MDL Number: MFCD00007526 InChI Key: AIMUHNZKNFEZSN-UHFFFAOYSA-M Synonym: sodium decane-1-sulfonate,sodium 1-decanesulfonate,1-decanesulfonic acid sodium salt,1-decanesulfonic acid, sodium salt,decyl sodium sulfonate,sodium decane-1-sulphonate,ipc-alks-10,n-decylsulfonic acid, sodium salt,1-decanesulphonic acid, sodium salt,2-decanesulfonic acid, sodium salt PubChem CID: 2724181 IUPAC Name: sodium;decane-1-sulfonate SMILES: CCCCCCCCCCS(=O)(=O)[O-].[Na+]
| PubChem CID | 2724181 |
|---|---|
| CAS | 13419-61-9 |
| Molecular Weight (g/mol) | 244.325 |
| MDL Number | MFCD00007526 |
| SMILES | CCCCCCCCCCS(=O)(=O)[O-].[Na+] |
| Synonym | sodium decane-1-sulfonate,sodium 1-decanesulfonate,1-decanesulfonic acid sodium salt,1-decanesulfonic acid, sodium salt,decyl sodium sulfonate,sodium decane-1-sulphonate,ipc-alks-10,n-decylsulfonic acid, sodium salt,1-decanesulphonic acid, sodium salt,2-decanesulfonic acid, sodium salt |
| IUPAC Name | sodium;decane-1-sulfonate |
| InChI Key | AIMUHNZKNFEZSN-UHFFFAOYSA-M |
| Molecular Formula | C10H21NaO3S |
3-Mercaptohexyl Acetate 97.0+%, TCI America™
CAS: 136954-20-6 Molecular Formula: C8H16O2S Molecular Weight (g/mol): 176.274 MDL Number: MFCD00792516 InChI Key: JUCARGIKESIVLB-UHFFFAOYSA-N Synonym: Acetic Acid 3-Mercaptohexyl Ester PubChem CID: 518810 ChEBI: CHEBI:77818 IUPAC Name: 3-sulfanylhexyl acetate SMILES: CCCC(CCOC(=O)C)S
| PubChem CID | 518810 |
|---|---|
| CAS | 136954-20-6 |
| Molecular Weight (g/mol) | 176.274 |
| ChEBI | CHEBI:77818 |
| MDL Number | MFCD00792516 |
| SMILES | CCCC(CCOC(=O)C)S |
| Synonym | Acetic Acid 3-Mercaptohexyl Ester |
| IUPAC Name | 3-sulfanylhexyl acetate |
| InChI Key | JUCARGIKESIVLB-UHFFFAOYSA-N |
| Molecular Formula | C8H16O2S |
5-Hexenyl Acetate 98.0+%, TCI America™
CAS: 5048-26-0 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.20 MDL Number: MFCD00060856 InChI Key: MPLWNENKBSBMFN-UHFFFAOYSA-N Synonym: 5-hexenyl acetate,hex-5-en-1-yl acetate,acetic acid 5-hexenyl ester,5-hexen-1-ol, acetate,5-hexene-1-ol, acetate,acetic acid 5-hexen-1-yl ester,6-acetoxy-1-hexene,6-acetoxyhex-1-ene,5-hexenyl acetate #,acmc-1aw0j PubChem CID: 537536 IUPAC Name: hex-5-en-1-yl acetate SMILES: CC(=O)OCCCCC=C
| PubChem CID | 537536 |
|---|---|
| CAS | 5048-26-0 |
| Molecular Weight (g/mol) | 142.20 |
| MDL Number | MFCD00060856 |
| SMILES | CC(=O)OCCCCC=C |
| Synonym | 5-hexenyl acetate,hex-5-en-1-yl acetate,acetic acid 5-hexenyl ester,5-hexen-1-ol, acetate,5-hexene-1-ol, acetate,acetic acid 5-hexen-1-yl ester,6-acetoxy-1-hexene,6-acetoxyhex-1-ene,5-hexenyl acetate #,acmc-1aw0j |
| IUPAC Name | hex-5-en-1-yl acetate |
| InChI Key | MPLWNENKBSBMFN-UHFFFAOYSA-N |
| Molecular Formula | C8H14O2 |
1-Carbobenzoxy-3-methylimidazolium Trifluoromethanesulfonate 98.0+%, TCI America™
CAS: 163080-99-7 Molecular Formula: C13H13F3N2O5S Molecular Weight (g/mol): 366.311 InChI Key: ICFSDLPZJDDPHP-UHFFFAOYSA-M Synonym: 1-Carbobenzoxy-3-methylimidazolium Triflate, 1-Cbz-3-methylimidazolium Trifluoromethanesulfonate, 1-Cbz-3-methylimidazolium Triflate PubChem CID: 11858599 IUPAC Name: benzyl 3-methylimidazol-3-ium-1-carboxylate;trifluoromethanesulfonate SMILES: C[N+]1=CN(C=C1)C(=O)OCC2=CC=CC=C2.C(F)(F)(F)S(=O)(=O)[O-]
| PubChem CID | 11858599 |
|---|---|
| CAS | 163080-99-7 |
| Molecular Weight (g/mol) | 366.311 |
| SMILES | C[N+]1=CN(C=C1)C(=O)OCC2=CC=CC=C2.C(F)(F)(F)S(=O)(=O)[O-] |
| Synonym | 1-Carbobenzoxy-3-methylimidazolium Triflate, 1-Cbz-3-methylimidazolium Trifluoromethanesulfonate, 1-Cbz-3-methylimidazolium Triflate |
| IUPAC Name | benzyl 3-methylimidazol-3-ium-1-carboxylate;trifluoromethanesulfonate |
| InChI Key | ICFSDLPZJDDPHP-UHFFFAOYSA-M |
| Molecular Formula | C13H13F3N2O5S |
2,6-Difluoro-4-methoxyphenylboronic Acid (contains varying amounts of Anhydride), TCI America™
CAS: 406482-20-0 Molecular Formula: C7H7BF2O3 Molecular Weight (g/mol): 187.94 MDL Number: MFCD05664299 InChI Key: WVSZSFADEBGONQ-UHFFFAOYSA-N Synonym: 2,6-Difluoro-4-methoxybenzeneboronic Acid PubChem CID: 16217424 IUPAC Name: (2,6-difluoro-4-methoxyphenyl)boronic acid SMILES: COC1=CC(F)=C(B(O)O)C(F)=C1
| PubChem CID | 16217424 |
|---|---|
| CAS | 406482-20-0 |
| Molecular Weight (g/mol) | 187.94 |
| MDL Number | MFCD05664299 |
| SMILES | COC1=CC(F)=C(B(O)O)C(F)=C1 |
| Synonym | 2,6-Difluoro-4-methoxybenzeneboronic Acid |
| IUPAC Name | (2,6-difluoro-4-methoxyphenyl)boronic acid |
| InChI Key | WVSZSFADEBGONQ-UHFFFAOYSA-N |
| Molecular Formula | C7H7BF2O3 |
(S)-(+)-1,1'-Binaphthyl-2,2'-diyl Bis(trifluoromethanesulfonate) 93.0+%, TCI America™
CAS: 128544-05-8 Molecular Formula: C22H12F6O6S2 Molecular Weight (g/mol): 550.442 MDL Number: MFCD00274615 InChI Key: OYJLCOSEYYZULE-UHFFFAOYSA-N Synonym: r-1,1'-binaphthalene-2,2'-diyl bis trifluoromethanesulfonate,s-1,1'-binaphthalene-2,2'-diyl bis trifluoromethanesulfonate,r---1,1'-bi-2-naphthol bis trifluoromethanesulfonate,r---1,1'-binaphthol-2,2'-bis trifluoromethanesulfonate,s-+-1,1'-bi-2-naphthol bis trifluoromethanesulfonate,r-1,1'-binaphthyl-2,2'-diyl bis trifluoromethane sulphonate,s-+-1,1'-binaphthol-2,2'-bis trifluoromethanesulfonate,1,1'-bi-2-naphthol bis trifluoromethanesulfonate,s-1,1'-bi 2-naphthol bis trifluoromethanesulfonate,r---binol-tf2 PubChem CID: 389883 IUPAC Name: [1-[2-(trifluoromethylsulfonyloxy)naphthalen-1-yl]naphthalen-2-yl] trifluoromethanesulfonate SMILES: C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)OS(=O)(=O)C(F)(F)F)OS(=O)(=O)C(F)(F)F
| PubChem CID | 389883 |
|---|---|
| CAS | 128544-05-8 |
| Molecular Weight (g/mol) | 550.442 |
| MDL Number | MFCD00274615 |
| SMILES | C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)OS(=O)(=O)C(F)(F)F)OS(=O)(=O)C(F)(F)F |
| Synonym | r-1,1'-binaphthalene-2,2'-diyl bis trifluoromethanesulfonate,s-1,1'-binaphthalene-2,2'-diyl bis trifluoromethanesulfonate,r---1,1'-bi-2-naphthol bis trifluoromethanesulfonate,r---1,1'-binaphthol-2,2'-bis trifluoromethanesulfonate,s-+-1,1'-bi-2-naphthol bis trifluoromethanesulfonate,r-1,1'-binaphthyl-2,2'-diyl bis trifluoromethane sulphonate,s-+-1,1'-binaphthol-2,2'-bis trifluoromethanesulfonate,1,1'-bi-2-naphthol bis trifluoromethanesulfonate,s-1,1'-bi 2-naphthol bis trifluoromethanesulfonate,r---binol-tf2 |
| IUPAC Name | [1-[2-(trifluoromethylsulfonyloxy)naphthalen-1-yl]naphthalen-2-yl] trifluoromethanesulfonate |
| InChI Key | OYJLCOSEYYZULE-UHFFFAOYSA-N |
| Molecular Formula | C22H12F6O6S2 |
3-Amino-1-phenyl-2-pyrazolin-5-one 98.0+%, TCI America™
CAS: 4149-06-8 Molecular Formula: C9H9N3O Molecular Weight (g/mol): 175.19 MDL Number: MFCD00003137 InChI Key: LPOVZHYARSAVIZ-UHFFFAOYSA-N Synonym: 3-amino-1-phenyl-2-pyrazolin-5-one,3-amino-1-phenyl-1h-pyrazol-5 4h-one,3h-pyrazol-3-one, 5-amino-2,4-dihydro-2-phenyl,3-amino-1-phenyl-4,5-dihydro-1h-pyrazol-5-one,5-pyrazolone, 3-amino-1-phenyl,5-amino-2-phenyl-2,4-dihydro-3h-pyrazol-3-one,3h-pyrazol-3-one, 2,4-dihydro-5-amino-2-phenyl,2,4-dihydro-5-amino-2-phenyl-3h-pyrazol-3-one,acmc-1arey,lpovzhyarsaviz-uhfffaoysa PubChem CID: 77794 IUPAC Name: 5-amino-2-phenyl-4H-pyrazol-3-one SMILES: C1C(=NN(C1=O)C2=CC=CC=C2)N
| PubChem CID | 77794 |
|---|---|
| CAS | 4149-06-8 |
| Molecular Weight (g/mol) | 175.19 |
| MDL Number | MFCD00003137 |
| SMILES | C1C(=NN(C1=O)C2=CC=CC=C2)N |
| Synonym | 3-amino-1-phenyl-2-pyrazolin-5-one,3-amino-1-phenyl-1h-pyrazol-5 4h-one,3h-pyrazol-3-one, 5-amino-2,4-dihydro-2-phenyl,3-amino-1-phenyl-4,5-dihydro-1h-pyrazol-5-one,5-pyrazolone, 3-amino-1-phenyl,5-amino-2-phenyl-2,4-dihydro-3h-pyrazol-3-one,3h-pyrazol-3-one, 2,4-dihydro-5-amino-2-phenyl,2,4-dihydro-5-amino-2-phenyl-3h-pyrazol-3-one,acmc-1arey,lpovzhyarsaviz-uhfffaoysa |
| IUPAC Name | 5-amino-2-phenyl-4H-pyrazol-3-one |
| InChI Key | LPOVZHYARSAVIZ-UHFFFAOYSA-N |
| Molecular Formula | C9H9N3O |
N-(1-Isopropoxyethyl)acetamide 93.0+%, TCI America™
CAS: 115910-75-3 Molecular Formula: C7H15NO2 Molecular Weight (g/mol): 145.202 MDL Number: MFCD00191526 InChI Key: PUMLTXLDRDSMGQ-UHFFFAOYSA-N PubChem CID: 14204909 IUPAC Name: N-(1-propan-2-yloxyethyl)acetamide SMILES: CC(C)OC(C)NC(=O)C
| PubChem CID | 14204909 |
|---|---|
| CAS | 115910-75-3 |
| Molecular Weight (g/mol) | 145.202 |
| MDL Number | MFCD00191526 |
| SMILES | CC(C)OC(C)NC(=O)C |
| IUPAC Name | N-(1-propan-2-yloxyethyl)acetamide |
| InChI Key | PUMLTXLDRDSMGQ-UHFFFAOYSA-N |
| Molecular Formula | C7H15NO2 |
Benzyl (S)-(-)-Lactate 98.0+%, TCI America™
CAS: 56777-24-3 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00209546 InChI Key: ZYTLPUIDJRKAAM-QMMMGPOBSA-N Synonym: benzyl s---lactate,benzyl l-lactate,benzyl s-lactate,s---lactic acid benzyl ester,benzyl 2s-2-hydroxypropanoate,benzyl-l-lactate,s-benzyllactate,s-benzyl lactate,s-lactic acid benzyl ester,2s-lactic acid benzyl ester PubChem CID: 11052238 IUPAC Name: benzyl (2S)-2-hydroxypropanoate SMILES: CC(C(=O)OCC1=CC=CC=C1)O
| PubChem CID | 11052238 |
|---|---|
| CAS | 56777-24-3 |
| Molecular Weight (g/mol) | 180.203 |
| MDL Number | MFCD00209546 |
| SMILES | CC(C(=O)OCC1=CC=CC=C1)O |
| Synonym | benzyl s---lactate,benzyl l-lactate,benzyl s-lactate,s---lactic acid benzyl ester,benzyl 2s-2-hydroxypropanoate,benzyl-l-lactate,s-benzyllactate,s-benzyl lactate,s-lactic acid benzyl ester,2s-lactic acid benzyl ester |
| IUPAC Name | benzyl (2S)-2-hydroxypropanoate |
| InChI Key | ZYTLPUIDJRKAAM-QMMMGPOBSA-N |
| Molecular Formula | C10H12O3 |
5-Fluoropyridine-3-boronic Acid (contains varying amounts of Anhydride), TCI America™
CAS: 872041-86-6 Molecular Formula: C5H5BFNO2 MDL Number: MFCD07368243 InChI Key: FVEDGBRHTGXPOK-UHFFFAOYSA-N PubChem CID: 44717403 IUPAC Name: (5-fluoropyridin-3-yl)boronic acid
| PubChem CID | 44717403 |
|---|---|
| CAS | 872041-86-6 |
| MDL Number | MFCD07368243 |
| IUPAC Name | (5-fluoropyridin-3-yl)boronic acid |
| InChI Key | FVEDGBRHTGXPOK-UHFFFAOYSA-N |
| Molecular Formula | C5H5BFNO2 |
5-Chloro-1-(4-piperidinyl)-2-benzimidazolinone 98.0+%, TCI America™
CAS: 53786-28-0 Molecular Formula: C12H14ClN3O Molecular Weight (g/mol): 251.714 MDL Number: MFCD02093793 InChI Key: DOAYWDKFDPSTSV-UHFFFAOYSA-N Synonym: 5-chloro-1-4-piperidyl-2-benzimidazolinone,5-chloro-1-piperidin-4-yl-1h-benzo d imidazol-2 3h-one,1-4-piperidinyl-1,3-dihydro-5-chlorobenzimidazolone,5-chloro-1,3-dihydro-1-4-piperidinyl-2h-benzimidazol-2-one,domperidone impurity a,5-chloro-1-piperidin-4-yl-1,3-dihydro-2h-benzimidazol-2-one,5-chloro-1-piperidin-4-yl-1,3-dihydro-benzoimidazol-2-one,4-5-chloro-2-oxo-2h-benzimidazol-1-yl piperidine,5-chloro-1-4-piperidyl-3-hydrobenzimidazol-2-one PubChem CID: 104607 IUPAC Name: 6-chloro-3-piperidin-4-yl-1H-benzimidazol-2-one SMILES: C1CNCCC1N2C3=C(C=C(C=C3)Cl)NC2=O
| PubChem CID | 104607 |
|---|---|
| CAS | 53786-28-0 |
| Molecular Weight (g/mol) | 251.714 |
| MDL Number | MFCD02093793 |
| SMILES | C1CNCCC1N2C3=C(C=C(C=C3)Cl)NC2=O |
| Synonym | 5-chloro-1-4-piperidyl-2-benzimidazolinone,5-chloro-1-piperidin-4-yl-1h-benzo d imidazol-2 3h-one,1-4-piperidinyl-1,3-dihydro-5-chlorobenzimidazolone,5-chloro-1,3-dihydro-1-4-piperidinyl-2h-benzimidazol-2-one,domperidone impurity a,5-chloro-1-piperidin-4-yl-1,3-dihydro-2h-benzimidazol-2-one,5-chloro-1-piperidin-4-yl-1,3-dihydro-benzoimidazol-2-one,4-5-chloro-2-oxo-2h-benzimidazol-1-yl piperidine,5-chloro-1-4-piperidyl-3-hydrobenzimidazol-2-one |
| IUPAC Name | 6-chloro-3-piperidin-4-yl-1H-benzimidazol-2-one |
| InChI Key | DOAYWDKFDPSTSV-UHFFFAOYSA-N |
| Molecular Formula | C12H14ClN3O |
1-Phenyl-1-cyclohexanecarboxylic Acid 95.0+%, TCI America™
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 |