Organic acids and derivatives
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Monosodium Risedronate Hemipentahydrate 98.0+%, TCI America™
CAS: 329003-65-8 Molecular Formula: C14H30N2Na2O19P4 Molecular Weight (g/mol): 700.264 MDL Number: MFCD01706268 InChI Key: HYFDYHPNTXOPPO-UHFFFAOYSA-L Synonym: Monosodium 1-Hydroxy-2-(3-pyridyl)ethylidene-1,1-diphosphonate, Risedronic Acid Monosodium Salt PubChem CID: 11954322 IUPAC Name: disodium;hydroxy-(1-hydroxy-1-phosphono-2-pyridin-3-ylethyl)phosphinate;pentahydrate SMILES: C1=CC(=CN=C1)CC(O)(P(=O)(O)O)P(=O)(O)[O-].C1=CC(=CN=C1)CC(O)(P(=O)(O)O)P(=O)(O)[O-].O.O.O.O.O.[Na+].[Na+]
| PubChem CID | 11954322 |
|---|---|
| CAS | 329003-65-8 |
| Molecular Weight (g/mol) | 700.264 |
| MDL Number | MFCD01706268 |
| SMILES | C1=CC(=CN=C1)CC(O)(P(=O)(O)O)P(=O)(O)[O-].C1=CC(=CN=C1)CC(O)(P(=O)(O)O)P(=O)(O)[O-].O.O.O.O.O.[Na+].[Na+] |
| Synonym | Monosodium 1-Hydroxy-2-(3-pyridyl)ethylidene-1,1-diphosphonate, Risedronic Acid Monosodium Salt |
| IUPAC Name | disodium;hydroxy-(1-hydroxy-1-phosphono-2-pyridin-3-ylethyl)phosphinate;pentahydrate |
| InChI Key | HYFDYHPNTXOPPO-UHFFFAOYSA-L |
| Molecular Formula | C14H30N2Na2O19P4 |
Diethyl 4-Methoxyphenylphosphonate 97.0+%, TCI America™
CAS: 3762-33-2 Molecular Formula: C11H17O4P Molecular Weight (g/mol): 244.227 MDL Number: MFCD00015670 InChI Key: OTUVLLBGFFIEJO-UHFFFAOYSA-N Synonym: 4-Methoxyphenylphosphonic Acid Diethyl Ester PubChem CID: 604767 IUPAC Name: 1-diethoxyphosphoryl-4-methoxybenzene SMILES: CCOP(=O)(C1=CC=C(C=C1)OC)OCC
| PubChem CID | 604767 |
|---|---|
| CAS | 3762-33-2 |
| Molecular Weight (g/mol) | 244.227 |
| MDL Number | MFCD00015670 |
| SMILES | CCOP(=O)(C1=CC=C(C=C1)OC)OCC |
| Synonym | 4-Methoxyphenylphosphonic Acid Diethyl Ester |
| IUPAC Name | 1-diethoxyphosphoryl-4-methoxybenzene |
| InChI Key | OTUVLLBGFFIEJO-UHFFFAOYSA-N |
| Molecular Formula | C11H17O4P |
Dimethyl (2-Oxopropyl)phosphonate 95.0+%, TCI America™
CAS: 4202-14-6 Molecular Formula: C5H11O4P Molecular Weight (g/mol): 166.113 MDL Number: MFCD00008769 InChI Key: UOWIYNWMROWVDG-UHFFFAOYSA-N Synonym: dimethyl 2-oxopropyl phosphonate,dimethyl acetylmethylphosphonate,dimethyl 2-oxopropylphosphonate,dimethyl acetonylphosphonate,2-oxopropyl phosphonic acid dimethyl ester,1-dimethoxycarbonyl acetone,acmc-209jmw,dimethoxyphosphoryl acetone PubChem CID: 77872 IUPAC Name: 1-dimethoxyphosphorylpropan-2-one SMILES: CC(=O)CP(=O)(OC)OC
| PubChem CID | 77872 |
|---|---|
| CAS | 4202-14-6 |
| Molecular Weight (g/mol) | 166.113 |
| MDL Number | MFCD00008769 |
| SMILES | CC(=O)CP(=O)(OC)OC |
| Synonym | dimethyl 2-oxopropyl phosphonate,dimethyl acetylmethylphosphonate,dimethyl 2-oxopropylphosphonate,dimethyl acetonylphosphonate,2-oxopropyl phosphonic acid dimethyl ester,1-dimethoxycarbonyl acetone,acmc-209jmw,dimethoxyphosphoryl acetone |
| IUPAC Name | 1-dimethoxyphosphorylpropan-2-one |
| InChI Key | UOWIYNWMROWVDG-UHFFFAOYSA-N |
| Molecular Formula | C5H11O4P |
Diethyl [(Tetrahydropyran-2-yloxy)methyl]phosphonate 96.0+%, TCI America™
CAS: 71885-51-3 Molecular Formula: C10H21O5P Molecular Weight (g/mol): 252.247 MDL Number: MFCD09263515 InChI Key: RUPVGTAIRUGQIQ-UHFFFAOYSA-N Synonym: [(Tetrahydropyran-2-yloxy)methyl]phosphonic Acid Diethyl Ester PubChem CID: 11230495 IUPAC Name: 2-(diethoxyphosphorylmethoxy)oxane SMILES: CCOP(=O)(COC1CCCCO1)OCC
| PubChem CID | 11230495 |
|---|---|
| CAS | 71885-51-3 |
| Molecular Weight (g/mol) | 252.247 |
| MDL Number | MFCD09263515 |
| SMILES | CCOP(=O)(COC1CCCCO1)OCC |
| Synonym | [(Tetrahydropyran-2-yloxy)methyl]phosphonic Acid Diethyl Ester |
| IUPAC Name | 2-(diethoxyphosphorylmethoxy)oxane |
| InChI Key | RUPVGTAIRUGQIQ-UHFFFAOYSA-N |
| Molecular Formula | C10H21O5P |
Heptylphosphonic Acid 98.0+%, TCI America™
CAS: 4721-16-8 Molecular Formula: C7H17O3P Molecular Weight (g/mol): 180.184 MDL Number: MFCD00015840 InChI Key: VAJFLSRDMGNZJY-UHFFFAOYSA-N PubChem CID: 3870222 IUPAC Name: heptylphosphonic acid SMILES: CCCCCCCP(=O)(O)O
| PubChem CID | 3870222 |
|---|---|
| CAS | 4721-16-8 |
| Molecular Weight (g/mol) | 180.184 |
| MDL Number | MFCD00015840 |
| SMILES | CCCCCCCP(=O)(O)O |
| IUPAC Name | heptylphosphonic acid |
| InChI Key | VAJFLSRDMGNZJY-UHFFFAOYSA-N |
| Molecular Formula | C7H17O3P |
Diethyl (Bromodifluoromethyl)phosphonate 97.0+%, TCI America™
CAS: 65094-22-6 Molecular Formula: C5H10BrF2O3P Molecular Weight (g/mol): 267.01 MDL Number: MFCD00069118 InChI Key: QRADKVYIJIAENZ-UHFFFAOYSA-N Synonym: diethyl bromodifluoromethyl phosphonate,bromodifluoromethyl diethylphosphonate,diethyl bromodifluoromethanephosphonate,diethyl bromodifluoromethylphosphonate,bromodifluoromethyl phosphonic acid diethyl ester,1-bromo difluoro methyl-ethoxyphosphoryl oxyethane,phosphonic acid, bromodifluoromethyl-, diethyl ester,pubchem24183,acmc-20ai7p PubChem CID: 144101 IUPAC Name: diethyl (bromodifluoromethyl)phosphonate SMILES: CCOP(=O)(OCC)C(F)(F)Br
| PubChem CID | 144101 |
|---|---|
| CAS | 65094-22-6 |
| Molecular Weight (g/mol) | 267.01 |
| MDL Number | MFCD00069118 |
| SMILES | CCOP(=O)(OCC)C(F)(F)Br |
| Synonym | diethyl bromodifluoromethyl phosphonate,bromodifluoromethyl diethylphosphonate,diethyl bromodifluoromethanephosphonate,diethyl bromodifluoromethylphosphonate,bromodifluoromethyl phosphonic acid diethyl ester,1-bromo difluoro methyl-ethoxyphosphoryl oxyethane,phosphonic acid, bromodifluoromethyl-, diethyl ester,pubchem24183,acmc-20ai7p |
| IUPAC Name | diethyl (bromodifluoromethyl)phosphonate |
| InChI Key | QRADKVYIJIAENZ-UHFFFAOYSA-N |
| Molecular Formula | C5H10BrF2O3P |
1,5-Pentylenediphosphonic Acid 98.0+%, TCI America™
CAS: 4672-25-7 Molecular Formula: C5H14O6P2 Molecular Weight (g/mol): 232.11 MDL Number: MFCD00800268 InChI Key: QRKINCQKOGXVEO-UHFFFAOYSA-N Synonym: 1,5-Pentanediphosphonic Acid PubChem CID: 2773804 IUPAC Name: (5-phosphonopentyl)phosphonic acid SMILES: OP(O)(=O)CCCCCP(O)(O)=O
| PubChem CID | 2773804 |
|---|---|
| CAS | 4672-25-7 |
| Molecular Weight (g/mol) | 232.11 |
| MDL Number | MFCD00800268 |
| SMILES | OP(O)(=O)CCCCCP(O)(O)=O |
| Synonym | 1,5-Pentanediphosphonic Acid |
| IUPAC Name | (5-phosphonopentyl)phosphonic acid |
| InChI Key | QRKINCQKOGXVEO-UHFFFAOYSA-N |
| Molecular Formula | C5H14O6P2 |
Tetraisopropyl Methylenediphosphonate 97.0+%, TCI America™
CAS: 1660-95-3 Molecular Formula: C13H30O6P2 Molecular Weight (g/mol): 344.325 MDL Number: MFCD00015021 InChI Key: ODTQUKVFOLFLIQ-UHFFFAOYSA-N Synonym: tetraisopropyl methylenediphosphonate,phosphonic acid, methylenebis-, tetrakis 1-methylethyl ester,tetraisopropyl methylenebisphosphonate,unii-k46y5v9u61,tetraisopropyl methylenebis phosphonate,methylenediphosphonic acid tetraisopropyl ester,tetra-i-propylmethylenediphosphonate,2-di propan-2-yloxy phosphorylmethyl-propan-2-yloxyphosphoryl oxypropane,phosphonic acid, p,p'-methylenebis-, p,p,p',p'-tetrakis 1-methylethyl ester,dsstox_cid_24847 PubChem CID: 74266 IUPAC Name: 2-[di(propan-2-yloxy)phosphorylmethyl-propan-2-yloxyphosphoryl]oxypropane SMILES: CC(C)OP(=O)(CP(=O)(OC(C)C)OC(C)C)OC(C)C
| PubChem CID | 74266 |
|---|---|
| CAS | 1660-95-3 |
| Molecular Weight (g/mol) | 344.325 |
| MDL Number | MFCD00015021 |
| SMILES | CC(C)OP(=O)(CP(=O)(OC(C)C)OC(C)C)OC(C)C |
| Synonym | tetraisopropyl methylenediphosphonate,phosphonic acid, methylenebis-, tetrakis 1-methylethyl ester,tetraisopropyl methylenebisphosphonate,unii-k46y5v9u61,tetraisopropyl methylenebis phosphonate,methylenediphosphonic acid tetraisopropyl ester,tetra-i-propylmethylenediphosphonate,2-di propan-2-yloxy phosphorylmethyl-propan-2-yloxyphosphoryl oxypropane,phosphonic acid, p,p'-methylenebis-, p,p,p',p'-tetrakis 1-methylethyl ester,dsstox_cid_24847 |
| IUPAC Name | 2-[di(propan-2-yloxy)phosphorylmethyl-propan-2-yloxyphosphoryl]oxypropane |
| InChI Key | ODTQUKVFOLFLIQ-UHFFFAOYSA-N |
| Molecular Formula | C13H30O6P2 |
Methyl Diethylphosphonoacetate 96.0+%, TCI America™
CAS: 1067-74-9 Molecular Formula: C7H15O5P Molecular Weight (g/mol): 210.166 MDL Number: MFCD00009081 InChI Key: CTSAXXHOGZNKJR-UHFFFAOYSA-N Synonym: methyl diethylphosphonoacetate,methyl 2-diethoxyphosphoryl acetate,acetic acid, diethoxyphosphinyl-, methyl ester,diethylmethylphosphonoacetate,methyl diethoxyphosphoryl acetate,diethyl carbomethoxymethylphosphonate,methyl 2-diethoxycarbonyl acetate,methyldiethylphosphonoacetate,diethyl methylphosphonoacetate,ksc489e0f PubChem CID: 66113 IUPAC Name: methyl 2-diethoxyphosphorylacetate SMILES: CCOP(=O)(CC(=O)OC)OCC
| PubChem CID | 66113 |
|---|---|
| CAS | 1067-74-9 |
| Molecular Weight (g/mol) | 210.166 |
| MDL Number | MFCD00009081 |
| SMILES | CCOP(=O)(CC(=O)OC)OCC |
| Synonym | methyl diethylphosphonoacetate,methyl 2-diethoxyphosphoryl acetate,acetic acid, diethoxyphosphinyl-, methyl ester,diethylmethylphosphonoacetate,methyl diethoxyphosphoryl acetate,diethyl carbomethoxymethylphosphonate,methyl 2-diethoxycarbonyl acetate,methyldiethylphosphonoacetate,diethyl methylphosphonoacetate,ksc489e0f |
| IUPAC Name | methyl 2-diethoxyphosphorylacetate |
| InChI Key | CTSAXXHOGZNKJR-UHFFFAOYSA-N |
| Molecular Formula | C7H15O5P |
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 |
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 |
Oleamide 65.0+%, TCI America™
CAS: 301-02-0 Molecular Formula: C18H35NO Molecular Weight (g/mol): 281.484 MDL Number: MFCD00053638 InChI Key: FATBGEAMYMYZAF-KTKRTIGZSA-N Synonym: oleamide,oleic acid amide,oleylamide,oleyl amide,adogen 73,crodamide o,slip-eze,armoslip cp,crodamide or,cis-9,10-octadecenoamide PubChem CID: 5283387 ChEBI: CHEBI:116314 IUPAC Name: (Z)-octadec-9-enamide SMILES: CCCCCCCCC=CCCCCCCCC(=O)N
| PubChem CID | 5283387 |
|---|---|
| CAS | 301-02-0 |
| Molecular Weight (g/mol) | 281.484 |
| ChEBI | CHEBI:116314 |
| MDL Number | MFCD00053638 |
| SMILES | CCCCCCCCC=CCCCCCCCC(=O)N |
| Synonym | oleamide,oleic acid amide,oleylamide,oleyl amide,adogen 73,crodamide o,slip-eze,armoslip cp,crodamide or,cis-9,10-octadecenoamide |
| IUPAC Name | (Z)-octadec-9-enamide |
| InChI Key | FATBGEAMYMYZAF-KTKRTIGZSA-N |
| Molecular Formula | C18H35NO |
| PubChem CID | 2773375 |
|---|---|
| CAS | 389621-80-1 |
| MDL Number | MFCD03411949 |
| Color | White |
| Physical Form | Crystalline Powder |
| TSCA | No |
| IUPAC Name | [4-(diethylcarbamoyl)phenyl]boronic acid |
| InChI Key | ZCGVBHIMRVYWOH-UHFFFAOYSA-N |
| Molecular Formula | C11H16BNO3 |
| Formula Weight | 221.06 |
| Melting Point | 142°C |
Tri-O-acetyl-D-galactal 95.0+%, TCI America™
CAS: 4098-06-0 Molecular Formula: C12H16O7 Molecular Weight (g/mol): 272.25 MDL Number: MFCD00064092 InChI Key: LLPWGHLVUPBSLP-UHFFFAOYNA-N Synonym: 3,4,6-tri-o-acetyl-d-galactal,tri-o-acetyl-d-galactal,2r,3r,4r-2-acetoxymethyl-3,4-dihydro-2h-pyran-3,4-diyl diacetate,d-arabino-hex-5-enitol, 2,6-anhydro-5-deoxy-, triacetate,1,3,4-tri-o-acetyl-2,6-anhydro-5-deoxyhex-5-enitol,d-galactal triacetate,2,6-anhydro-5-deoxy-d-arabino-hex-5-enitol triacetate,2r,3r,4r-3,4-bis acetyloxy-3,4-dihydro-2h-pyran-2-yl methyl acetate,galactal triacetate,tri-o-acetylgalactal PubChem CID: 640125 IUPAC Name: [3,4-bis(acetyloxy)-3,4-dihydro-2H-pyran-2-yl]methyl acetate SMILES: CC(=O)OCC1OC=CC(OC(C)=O)C1OC(C)=O
| PubChem CID | 640125 |
|---|---|
| CAS | 4098-06-0 |
| Molecular Weight (g/mol) | 272.25 |
| MDL Number | MFCD00064092 |
| SMILES | CC(=O)OCC1OC=CC(OC(C)=O)C1OC(C)=O |
| Synonym | 3,4,6-tri-o-acetyl-d-galactal,tri-o-acetyl-d-galactal,2r,3r,4r-2-acetoxymethyl-3,4-dihydro-2h-pyran-3,4-diyl diacetate,d-arabino-hex-5-enitol, 2,6-anhydro-5-deoxy-, triacetate,1,3,4-tri-o-acetyl-2,6-anhydro-5-deoxyhex-5-enitol,d-galactal triacetate,2,6-anhydro-5-deoxy-d-arabino-hex-5-enitol triacetate,2r,3r,4r-3,4-bis acetyloxy-3,4-dihydro-2h-pyran-2-yl methyl acetate,galactal triacetate,tri-o-acetylgalactal |
| IUPAC Name | [3,4-bis(acetyloxy)-3,4-dihydro-2H-pyran-2-yl]methyl acetate |
| InChI Key | LLPWGHLVUPBSLP-UHFFFAOYNA-N |
| Molecular Formula | C12H16O7 |
Trimellitic Acid 98.0+%, TCI America™
CAS: 528-44-9 Molecular Formula: C9H6O6 Molecular Weight (g/mol): 210.14 MDL Number: MFCD00002470 InChI Key: ARCGXLSVLAOJQL-UHFFFAOYSA-N Synonym: 1,2,4-benzenetricarboxylic acid,trimellitic acid,1,2,4-tricarboxybenzene,4-carboxyphthalic acid,1,3,4-benzenetricarboxylic acid,1,4,5-benzenetricarboxylic acid,1,2,4-benzenetricarboxylicacid,unii-7nvy29mq5f,7nvy29mq5f,dsstox_cid_1487 PubChem CID: 10708 ChEBI: CHEBI:166055 IUPAC Name: benzene-1,2,4-tricarboxylic acid SMILES: OC(=O)C1=CC=C(C(O)=O)C(=C1)C(O)=O
| PubChem CID | 10708 |
|---|---|
| CAS | 528-44-9 |
| Molecular Weight (g/mol) | 210.14 |
| ChEBI | CHEBI:166055 |
| MDL Number | MFCD00002470 |
| SMILES | OC(=O)C1=CC=C(C(O)=O)C(=C1)C(O)=O |
| Synonym | 1,2,4-benzenetricarboxylic acid,trimellitic acid,1,2,4-tricarboxybenzene,4-carboxyphthalic acid,1,3,4-benzenetricarboxylic acid,1,4,5-benzenetricarboxylic acid,1,2,4-benzenetricarboxylicacid,unii-7nvy29mq5f,7nvy29mq5f,dsstox_cid_1487 |
| IUPAC Name | benzene-1,2,4-tricarboxylic acid |
| InChI Key | ARCGXLSVLAOJQL-UHFFFAOYSA-N |
| Molecular Formula | C9H6O6 |