Organic acids and derivatives
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3-Buten-2-yl Acetate 98.0+%, TCI America™
CAS: 6737-11-7 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.14 MDL Number: MFCD00026202 InChI Key: LYWCPTCPTWCZSZ-UHFFFAOYNA-N Synonym: 3-Acetoxy-1-butene, Acetic Acid 3-Buten-2-yl Ester, 1-Methylallyl Acetate PubChem CID: 138821 IUPAC Name: but-3-en-2-yl acetate SMILES: CC(C=C)OC(=O)C
| PubChem CID | 138821 |
|---|---|
| CAS | 6737-11-7 |
| Molecular Weight (g/mol) | 114.14 |
| MDL Number | MFCD00026202 |
| SMILES | CC(C=C)OC(=O)C |
| Synonym | 3-Acetoxy-1-butene, Acetic Acid 3-Buten-2-yl Ester, 1-Methylallyl Acetate |
| IUPAC Name | but-3-en-2-yl acetate |
| InChI Key | LYWCPTCPTWCZSZ-UHFFFAOYNA-N |
| Molecular Formula | C6H10O2 |
Isopropyl Hexanoate 98.0+%, TCI America™
CAS: 2311-46-8 Molecular Formula: C9H18O2 Molecular Weight (g/mol): 158.241 MDL Number: MFCD00059436 InChI Key: JSHDAORXSNJOBA-UHFFFAOYSA-N Synonym: Hexanoic Acid Isopropyl Ester PubChem CID: 16832 IUPAC Name: propan-2-yl hexanoate SMILES: CCCCCC(=O)OC(C)C
| PubChem CID | 16832 |
|---|---|
| CAS | 2311-46-8 |
| Molecular Weight (g/mol) | 158.241 |
| MDL Number | MFCD00059436 |
| SMILES | CCCCCC(=O)OC(C)C |
| Synonym | Hexanoic Acid Isopropyl Ester |
| IUPAC Name | propan-2-yl hexanoate |
| InChI Key | JSHDAORXSNJOBA-UHFFFAOYSA-N |
| Molecular Formula | C9H18O2 |
Diethyl (4-Nitrobenzyl)phosphonate 97.0+%, TCI America™
CAS: 2609-49-6 Molecular Formula: C11H16NO5P Molecular Weight (g/mol): 273.225 MDL Number: MFCD00047747 InChI Key: FORMFFDDQMCTCT-UHFFFAOYSA-N Synonym: diethyl 4-nitrobenzylphosphonate,diethyl 4-nitrobenzyl phosphonate,diethyl 4-nitrophenyl methylphosphonate,1-diethoxyphosphorylmethyl-4-nitro-benzene,1-diethoxyphosphorylmethyl-4-nitrobenzene,phosphonic acid, 4-nitrophenyl methyl-, diethyl ester,phosphonic acid, p-4-nitrophenyl methyl-, diethyl ester,zlchem 660,diethyl4-nitrobenzylphosphonate PubChem CID: 256065 IUPAC Name: 1-(diethoxyphosphorylmethyl)-4-nitrobenzene SMILES: CCOP(=O)(CC1=CC=C(C=C1)[N+](=O)[O-])OCC
| PubChem CID | 256065 |
|---|---|
| CAS | 2609-49-6 |
| Molecular Weight (g/mol) | 273.225 |
| MDL Number | MFCD00047747 |
| SMILES | CCOP(=O)(CC1=CC=C(C=C1)[N+](=O)[O-])OCC |
| Synonym | diethyl 4-nitrobenzylphosphonate,diethyl 4-nitrobenzyl phosphonate,diethyl 4-nitrophenyl methylphosphonate,1-diethoxyphosphorylmethyl-4-nitro-benzene,1-diethoxyphosphorylmethyl-4-nitrobenzene,phosphonic acid, 4-nitrophenyl methyl-, diethyl ester,phosphonic acid, p-4-nitrophenyl methyl-, diethyl ester,zlchem 660,diethyl4-nitrobenzylphosphonate |
| IUPAC Name | 1-(diethoxyphosphorylmethyl)-4-nitrobenzene |
| InChI Key | FORMFFDDQMCTCT-UHFFFAOYSA-N |
| Molecular Formula | C11H16NO5P |
(4-Bromobutyl)phosphonic Acid 98.0+%, TCI America™
CAS: 1190-14-3 Molecular Formula: C4H10BrO3P Molecular Weight (g/mol): 217.00 MDL Number: MFCD00466589 InChI Key: FXFARGAYPHUQQL-UHFFFAOYSA-N PubChem CID: 18409311 IUPAC Name: (4-bromobutyl)phosphonic acid SMILES: OP(O)(=O)CCCCBr
| PubChem CID | 18409311 |
|---|---|
| CAS | 1190-14-3 |
| Molecular Weight (g/mol) | 217.00 |
| MDL Number | MFCD00466589 |
| SMILES | OP(O)(=O)CCCCBr |
| IUPAC Name | (4-bromobutyl)phosphonic acid |
| InChI Key | FXFARGAYPHUQQL-UHFFFAOYSA-N |
| Molecular Formula | C4H10BrO3P |
Dihexyl N,N-Diethylcarbamylmethylenephosphonate 90.0+%, TCI America™
CAS: 7369-66-6 Molecular Formula: C18H38NO4P Molecular Weight (g/mol): 363.48 MDL Number: MFCD00015502 InChI Key: MSULAAVSYZOTHM-UHFFFAOYSA-N Synonym: N,N-Diethylcarbamoylmethylphosphonic Acid Dihexyl Ester, Dihexyl N,N-Diethylcarbamoylmethylphosphonate, DHDECMP PubChem CID: 12865231 IUPAC Name: dihexyl [(diethylcarbamoyl)methyl]phosphonate SMILES: CCCCCCOP(=O)(CC(=O)N(CC)CC)OCCCCCC
| PubChem CID | 12865231 |
|---|---|
| CAS | 7369-66-6 |
| Molecular Weight (g/mol) | 363.48 |
| MDL Number | MFCD00015502 |
| SMILES | CCCCCCOP(=O)(CC(=O)N(CC)CC)OCCCCCC |
| Synonym | N,N-Diethylcarbamoylmethylphosphonic Acid Dihexyl Ester, Dihexyl N,N-Diethylcarbamoylmethylphosphonate, DHDECMP |
| IUPAC Name | dihexyl [(diethylcarbamoyl)methyl]phosphonate |
| InChI Key | MSULAAVSYZOTHM-UHFFFAOYSA-N |
| Molecular Formula | C18H38NO4P |
Glycine-N,N-bis(methylenephosphonic Acid) 97.0+%, TCI America™
CAS: 2439-99-8 Molecular Formula: C4H11NO8P2 Molecular Weight (g/mol): 263.079 MDL Number: MFCD00056670 InChI Key: OXHDYFKENBXUEM-UHFFFAOYSA-N Synonym: glyphosine,n,n-bis phosphonomethyl glycine,glyphosphine,polaris,2-bis phosphonomethyl amino acetic acid,glycine, n,n-bis phosphonomethyl,glyphosine ansi,caswell no. 471a,unii-2u96121skr PubChem CID: 17112 ChEBI: CHEBI:63484 IUPAC Name: 2-[bis(phosphonomethyl)amino]acetic acid SMILES: C(C(=O)O)N(CP(=O)(O)O)CP(=O)(O)O
| PubChem CID | 17112 |
|---|---|
| CAS | 2439-99-8 |
| Molecular Weight (g/mol) | 263.079 |
| ChEBI | CHEBI:63484 |
| MDL Number | MFCD00056670 |
| SMILES | C(C(=O)O)N(CP(=O)(O)O)CP(=O)(O)O |
| Synonym | glyphosine,n,n-bis phosphonomethyl glycine,glyphosphine,polaris,2-bis phosphonomethyl amino acetic acid,glycine, n,n-bis phosphonomethyl,glyphosine ansi,caswell no. 471a,unii-2u96121skr |
| IUPAC Name | 2-[bis(phosphonomethyl)amino]acetic acid |
| InChI Key | OXHDYFKENBXUEM-UHFFFAOYSA-N |
| Molecular Formula | C4H11NO8P2 |
(Pyridin-2-ylmethyl)phosphonic Acid 98.0+%, TCI America™
CAS: 80241-45-8 Molecular Formula: C6H8NO3P Molecular Weight (g/mol): 173.108 MDL Number: MFCD16877725 InChI Key: WVWCWWLEFNGDBC-UHFFFAOYSA-N PubChem CID: 12730177 IUPAC Name: pyridin-2-ylmethylphosphonic acid SMILES: C1=CC=NC(=C1)CP(=O)(O)O
| PubChem CID | 12730177 |
|---|---|
| CAS | 80241-45-8 |
| Molecular Weight (g/mol) | 173.108 |
| MDL Number | MFCD16877725 |
| SMILES | C1=CC=NC(=C1)CP(=O)(O)O |
| IUPAC Name | pyridin-2-ylmethylphosphonic acid |
| InChI Key | WVWCWWLEFNGDBC-UHFFFAOYSA-N |
| Molecular Formula | C6H8NO3P |
Diethyl (Phthalimidomethyl)phosphonate 98.0+%, TCI America™
CAS: 33512-26-4 Molecular Formula: C13H16NO5P Molecular Weight (g/mol): 297.247 MDL Number: MFCD00134313 InChI Key: IUZMHUAHKBHJFY-UHFFFAOYSA-N Synonym: diethyl phthalimidomethyl phosphonate,diethyl 1,3-dioxoisoindolin-2-yl methyl phosphonate,phthalimidomethyl phosphonic acid diethyl ester,diethyl 1,3-dioxoisoindol-2-yl methylphosphonate,2-diethoxycarbonyl methyl benzo c azoline-1,3-dione,acmc-1cp9b,diethyl phthalimidomethylphosphonate,n-diethoxyphosphoryl methyl phthalimide PubChem CID: 1924456 IUPAC Name: 2-(diethoxyphosphorylmethyl)isoindole-1,3-dione SMILES: CCOP(=O)(CN1C(=O)C2=CC=CC=C2C1=O)OCC
| PubChem CID | 1924456 |
|---|---|
| CAS | 33512-26-4 |
| Molecular Weight (g/mol) | 297.247 |
| MDL Number | MFCD00134313 |
| SMILES | CCOP(=O)(CN1C(=O)C2=CC=CC=C2C1=O)OCC |
| Synonym | diethyl phthalimidomethyl phosphonate,diethyl 1,3-dioxoisoindolin-2-yl methyl phosphonate,phthalimidomethyl phosphonic acid diethyl ester,diethyl 1,3-dioxoisoindol-2-yl methylphosphonate,2-diethoxycarbonyl methyl benzo c azoline-1,3-dione,acmc-1cp9b,diethyl phthalimidomethylphosphonate,n-diethoxyphosphoryl methyl phthalimide |
| IUPAC Name | 2-(diethoxyphosphorylmethyl)isoindole-1,3-dione |
| InChI Key | IUZMHUAHKBHJFY-UHFFFAOYSA-N |
| Molecular Formula | C13H16NO5P |
Ethyl Diethoxyphosphinylformate, TCI America™
CAS: 1474-78-8 Molecular Formula: C7H15O5P Molecular Weight (g/mol): 210.166 MDL Number: MFCD00009108 InChI Key: NOJFJZZMRDSOLM-UHFFFAOYSA-N Synonym: ethyl diethoxyphosphinylformate,triethyl phosphonoformate,triethyl carboxyphosphonate,diethyl ethoxycarbonylphosphonate,triethyl phosphonomethanoate,diethyl carbethoxyphosphonate,ethyldiethoxyphosphinylformate,ethyl diethoxyphosphoryl formate,unii-tux6m928id,phosphinecarboxylic acid, diethoxy-, ethyl ester, oxide PubChem CID: 65081 IUPAC Name: ethyl diethoxyphosphorylformate SMILES: CCOC(=O)P(=O)(OCC)OCC
| PubChem CID | 65081 |
|---|---|
| CAS | 1474-78-8 |
| Molecular Weight (g/mol) | 210.166 |
| MDL Number | MFCD00009108 |
| SMILES | CCOC(=O)P(=O)(OCC)OCC |
| Synonym | ethyl diethoxyphosphinylformate,triethyl phosphonoformate,triethyl carboxyphosphonate,diethyl ethoxycarbonylphosphonate,triethyl phosphonomethanoate,diethyl carbethoxyphosphonate,ethyldiethoxyphosphinylformate,ethyl diethoxyphosphoryl formate,unii-tux6m928id,phosphinecarboxylic acid, diethoxy-, ethyl ester, oxide |
| IUPAC Name | ethyl diethoxyphosphorylformate |
| InChI Key | NOJFJZZMRDSOLM-UHFFFAOYSA-N |
| Molecular Formula | C7H15O5P |
Decylphosphonic Acid 98.0+%, TCI America™
CAS: 6874-60-8 Molecular Formula: C10H23O3P Molecular Weight (g/mol): 222.265 MDL Number: MFCD00015830 InChI Key: DZQISOJKASMITI-UHFFFAOYSA-N Synonym: decanephosphonic acid,phosphonic acid, decyl,1-decanephosphonic acid,decyl-phosphonic acid,1-decylphosphonic acid,n-decylphosphonic acid,phosphonic acid, p-decyl,decylphosphonicacid,n-decanephosphonic acid,acmc-1cuhv PubChem CID: 81309 IUPAC Name: decylphosphonic acid SMILES: CCCCCCCCCCP(=O)(O)O
| PubChem CID | 81309 |
|---|---|
| CAS | 6874-60-8 |
| Molecular Weight (g/mol) | 222.265 |
| MDL Number | MFCD00015830 |
| SMILES | CCCCCCCCCCP(=O)(O)O |
| Synonym | decanephosphonic acid,phosphonic acid, decyl,1-decanephosphonic acid,decyl-phosphonic acid,1-decylphosphonic acid,n-decylphosphonic acid,phosphonic acid, p-decyl,decylphosphonicacid,n-decanephosphonic acid,acmc-1cuhv |
| IUPAC Name | decylphosphonic acid |
| InChI Key | DZQISOJKASMITI-UHFFFAOYSA-N |
| Molecular Formula | C10H23O3P |
Mono-2-ethylhexyl (2-Ethylhexyl)phosphonate 95.0+%, TCI America™
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CAS: 14802-03-0 Molecular Formula: C16H35O3P Molecular Weight (g/mol): 306.427 MDL Number: MFCD00467188 InChI Key: ZDFBXXSHBTVQMB-UHFFFAOYSA-N Synonym: (2-Ethylhexyl)phosphonic Acid Mono-2-ethylhexyl Ester, 2-Ethylhexyl Hydrogen (2-Ethylhexyl)phosphonate, HEHEHP, PC 88A PubChem CID: 85771 IUPAC Name: 2-ethylhexoxy(2-ethylhexyl)phosphinic acid SMILES: CCCCC(CC)COP(=O)(CC(CC)CCCC)O
| PubChem CID | 85771 |
|---|---|
| CAS | 14802-03-0 |
| Molecular Weight (g/mol) | 306.427 |
| MDL Number | MFCD00467188 |
| SMILES | CCCCC(CC)COP(=O)(CC(CC)CCCC)O |
| Synonym | (2-Ethylhexyl)phosphonic Acid Mono-2-ethylhexyl Ester, 2-Ethylhexyl Hydrogen (2-Ethylhexyl)phosphonate, HEHEHP, PC 88A |
| IUPAC Name | 2-ethylhexoxy(2-ethylhexyl)phosphinic acid |
| InChI Key | ZDFBXXSHBTVQMB-UHFFFAOYSA-N |
| Molecular Formula | C16H35O3P |
1,6-Hexylenediphosphonic Acid 98.0+%, TCI America™
CAS: 4721-22-6 Molecular Formula: C6H16O6P2 Molecular Weight (g/mol): 246.136 MDL Number: MFCD01630742 InChI Key: WDYVUKGVKRZQNM-UHFFFAOYSA-N Synonym: 1,6-Hexanediphosphonic Acid PubChem CID: 2773795 IUPAC Name: 6-phosphonohexylphosphonic acid SMILES: C(CCCP(=O)(O)O)CCP(=O)(O)O
| PubChem CID | 2773795 |
|---|---|
| CAS | 4721-22-6 |
| Molecular Weight (g/mol) | 246.136 |
| MDL Number | MFCD01630742 |
| SMILES | C(CCCP(=O)(O)O)CCP(=O)(O)O |
| Synonym | 1,6-Hexanediphosphonic Acid |
| IUPAC Name | 6-phosphonohexylphosphonic acid |
| InChI Key | WDYVUKGVKRZQNM-UHFFFAOYSA-N |
| Molecular Formula | C6H16O6P2 |
tert-Butyl Diethylphosphonoacetate 97.0+%, TCI America™
CAS: 27784-76-5 Molecular Formula: C10H21O5P Molecular Weight (g/mol): 252.247 InChI Key: NFEGNISFSSLEGU-UHFFFAOYSA-N Synonym: tert-butyl diethylphosphonoacetate,tert-butyl 2-diethoxyphosphoryl acetate,diethyl boc-methyl phosphonate,diethoxy-phosphoryl-acetic acid tert-butyl ester,t-butyl diethylphosphonoacetate,diethyl phosphonoacetic acid tert-butyl ester,t-butyl diethyl phosphonoacetate,diethylphosphonoacetic acid tert-butyl ester,diethyl 2-tert-butoxycarbonylmethyl phosphonate,acetic acid, diethoxyphosphinyl-, 1,1-dimethylethyl ester PubChem CID: 2773685 IUPAC Name: tert-butyl 2-diethoxyphosphorylacetate SMILES: CCOP(=O)(CC(=O)OC(C)(C)C)OCC
| PubChem CID | 2773685 |
|---|---|
| CAS | 27784-76-5 |
| Molecular Weight (g/mol) | 252.247 |
| SMILES | CCOP(=O)(CC(=O)OC(C)(C)C)OCC |
| Synonym | tert-butyl diethylphosphonoacetate,tert-butyl 2-diethoxyphosphoryl acetate,diethyl boc-methyl phosphonate,diethoxy-phosphoryl-acetic acid tert-butyl ester,t-butyl diethylphosphonoacetate,diethyl phosphonoacetic acid tert-butyl ester,t-butyl diethyl phosphonoacetate,diethylphosphonoacetic acid tert-butyl ester,diethyl 2-tert-butoxycarbonylmethyl phosphonate,acetic acid, diethoxyphosphinyl-, 1,1-dimethylethyl ester |
| IUPAC Name | tert-butyl 2-diethoxyphosphorylacetate |
| InChI Key | NFEGNISFSSLEGU-UHFFFAOYSA-N |
| Molecular Formula | C10H21O5P |
Ethyl Dimethylphosphonoacetate 97.0+%, TCI America™
CAS: 311-46-6 Molecular Formula: C6H13O5P Molecular Weight (g/mol): 196.139 MDL Number: MFCD00015677 InChI Key: HUNISAHOCCASGM-UHFFFAOYSA-N Synonym: Dimethylphosphonoacetic Acid Ethyl Ester PubChem CID: 67555 IUPAC Name: ethyl 2-dimethoxyphosphorylacetate SMILES: CCOC(=O)CP(=O)(OC)OC
| PubChem CID | 67555 |
|---|---|
| CAS | 311-46-6 |
| Molecular Weight (g/mol) | 196.139 |
| MDL Number | MFCD00015677 |
| SMILES | CCOC(=O)CP(=O)(OC)OC |
| Synonym | Dimethylphosphonoacetic Acid Ethyl Ester |
| IUPAC Name | ethyl 2-dimethoxyphosphorylacetate |
| InChI Key | HUNISAHOCCASGM-UHFFFAOYSA-N |
| Molecular Formula | C6H13O5P |
Alendronic Acid 98.0+%, TCI America™
CAS: 66376-36-1 Molecular Formula: C4H13NO7P2 Molecular Weight (g/mol): 249.096 MDL Number: MFCD00868112 InChI Key: OGSPWJRAVKPPFI-UHFFFAOYSA-N Synonym: 4-Amino-1-hydroxybutane-1,1-diphosphonic Acid PubChem CID: 2088 ChEBI: CHEBI:2567 IUPAC Name: (4-amino-1-hydroxy-1-phosphonobutyl)phosphonic acid SMILES: C(CC(O)(P(=O)(O)O)P(=O)(O)O)CN
| PubChem CID | 2088 |
|---|---|
| CAS | 66376-36-1 |
| Molecular Weight (g/mol) | 249.096 |
| ChEBI | CHEBI:2567 |
| MDL Number | MFCD00868112 |
| SMILES | C(CC(O)(P(=O)(O)O)P(=O)(O)O)CN |
| Synonym | 4-Amino-1-hydroxybutane-1,1-diphosphonic Acid |
| IUPAC Name | (4-amino-1-hydroxy-1-phosphonobutyl)phosphonic acid |
| InChI Key | OGSPWJRAVKPPFI-UHFFFAOYSA-N |
| Molecular Formula | C4H13NO7P2 |