Organic acids and derivatives
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N-(2-Aminoethyl)acetamide, 90%, Thermo Scientific Chemicals
CAS: 1001-53-2 Molecular Formula: C4H10N2O Molecular Weight (g/mol): 102.14 MDL Number: MFCD00008163 InChI Key: DAKZISABEDGGSV-UHFFFAOYSA-N Synonym: n-2-aminoethyl acetamide,n-acetylethylenediamine,acetamide, n-2-aminoethyl,n-2-amino-ethyl-acetamide,unii-fql33v3kzd,fql33v3kzd,acetylethylenediamine,2-acetamidoethylamine,acetylethylene diamine,n-acetylethylendiamine PubChem CID: 66082 IUPAC Name: N-(2-aminoethyl)acetamide SMILES: CC(=O)NCCN
| PubChem CID | 66082 |
|---|---|
| CAS | 1001-53-2 |
| Molecular Weight (g/mol) | 102.14 |
| MDL Number | MFCD00008163 |
| SMILES | CC(=O)NCCN |
| Synonym | n-2-aminoethyl acetamide,n-acetylethylenediamine,acetamide, n-2-aminoethyl,n-2-amino-ethyl-acetamide,unii-fql33v3kzd,fql33v3kzd,acetylethylenediamine,2-acetamidoethylamine,acetylethylene diamine,n-acetylethylendiamine |
| IUPAC Name | N-(2-aminoethyl)acetamide |
| InChI Key | DAKZISABEDGGSV-UHFFFAOYSA-N |
| Molecular Formula | C4H10N2O |
Diethyl trichloromethylphosphonate, 98%
CAS: 866-23-9 Molecular Formula: C5H10Cl3O3P Molecular Weight (g/mol): 255.46 MDL Number: MFCD00013666 InChI Key: RVAQSYWDOSHWGP-UHFFFAOYSA-N Synonym: diethyl trichloromethylphosphonate,diethyl trichloromethyl phosphonate,phosphonic acid, trichloromethyl-, diethyl ester,methanephosphonic acid, trichloro-, diethyl ester,diethyltrichloromethylphosphonate,wln: gxggpo&o2&o2,4-03-00-00262 beilstein handbook reference,trichloromethylphosphonic acid diethyl,diethoxyphosphino trichloromethyl-1-one PubChem CID: 70085 IUPAC Name: 1-[ethoxy(trichloromethyl)phosphoryl]oxyethane SMILES: CCOP(=O)(OCC)C(Cl)(Cl)Cl
| PubChem CID | 70085 |
|---|---|
| CAS | 866-23-9 |
| Molecular Weight (g/mol) | 255.46 |
| MDL Number | MFCD00013666 |
| SMILES | CCOP(=O)(OCC)C(Cl)(Cl)Cl |
| Synonym | diethyl trichloromethylphosphonate,diethyl trichloromethyl phosphonate,phosphonic acid, trichloromethyl-, diethyl ester,methanephosphonic acid, trichloro-, diethyl ester,diethyltrichloromethylphosphonate,wln: gxggpo&o2&o2,4-03-00-00262 beilstein handbook reference,trichloromethylphosphonic acid diethyl,diethoxyphosphino trichloromethyl-1-one |
| IUPAC Name | 1-[ethoxy(trichloromethyl)phosphoryl]oxyethane |
| InChI Key | RVAQSYWDOSHWGP-UHFFFAOYSA-N |
| Molecular Formula | C5H10Cl3O3P |
Tri-n-hexyl phosphate, 90+%
CAS: 2528-39-4 Molecular Formula: C18H39O4P Molecular Weight (g/mol): 350.48 MDL Number: MFCD00015351 InChI Key: SFENPMLASUEABX-UHFFFAOYSA-N Synonym: phosphoric acid, trihexyl ester,tri-n-hexyl phosphate,tri n-hexyl phosphate,acmc-20aje0,aronis24109 PubChem CID: 75666 IUPAC Name: trihexyl phosphate SMILES: CCCCCCOP(=O)(OCCCCCC)OCCCCCC
| PubChem CID | 75666 |
|---|---|
| CAS | 2528-39-4 |
| Molecular Weight (g/mol) | 350.48 |
| MDL Number | MFCD00015351 |
| SMILES | CCCCCCOP(=O)(OCCCCCC)OCCCCCC |
| Synonym | phosphoric acid, trihexyl ester,tri-n-hexyl phosphate,tri n-hexyl phosphate,acmc-20aje0,aronis24109 |
| IUPAC Name | trihexyl phosphate |
| InChI Key | SFENPMLASUEABX-UHFFFAOYSA-N |
| Molecular Formula | C18H39O4P |
2-(3-Methoxyallylidene)malonic acid dimethyl ester, 95%
CAS: 41530-32-9 Molecular Formula: C9H12O5 Molecular Weight (g/mol): 200.19 InChI Key: NOBNTZJTOBIOHL-GQCTYLIASA-N Synonym: 2-3-methoxyallylidene malonic acid dimethyl ester,dimethyl 2-3-methoxyallylidene malonate,1,3-dimethyl 2-2e-3-methoxyprop-2-en-1-ylidene propanedioate,2-3-methoxyallylidene malonic acid dimethyl ester, 96,dimethyl 2-e-3-methoxyprop-2-enylidene propanedioate,propanedioic acid, 3-methoxy-2-propenylidene-, dimethyl ester,dimethyl e-2-3-methoxyallylidene malonate,3-methoxy-2-propenylidene malonic acid dimethyl ester,dimethyl 2-2e-3-methoxy-2-propenylidene malonate # PubChem CID: 5374172 IUPAC Name: dimethyl 2-[(E)-3-methoxyprop-2-enylidene]propanedioate SMILES: COC=CC=C(C(=O)OC)C(=O)OC
| PubChem CID | 5374172 |
|---|---|
| CAS | 41530-32-9 |
| Molecular Weight (g/mol) | 200.19 |
| SMILES | COC=CC=C(C(=O)OC)C(=O)OC |
| Synonym | 2-3-methoxyallylidene malonic acid dimethyl ester,dimethyl 2-3-methoxyallylidene malonate,1,3-dimethyl 2-2e-3-methoxyprop-2-en-1-ylidene propanedioate,2-3-methoxyallylidene malonic acid dimethyl ester, 96,dimethyl 2-e-3-methoxyprop-2-enylidene propanedioate,propanedioic acid, 3-methoxy-2-propenylidene-, dimethyl ester,dimethyl e-2-3-methoxyallylidene malonate,3-methoxy-2-propenylidene malonic acid dimethyl ester,dimethyl 2-2e-3-methoxy-2-propenylidene malonate # |
| IUPAC Name | dimethyl 2-[(E)-3-methoxyprop-2-enylidene]propanedioate |
| InChI Key | NOBNTZJTOBIOHL-GQCTYLIASA-N |
| Molecular Formula | C9H12O5 |
TAPS, 99%
CAS: 29915-38-6 Molecular Formula: C7H17NO6S Molecular Weight (g/mol): 243.27 MDL Number: MFCD00007538 InChI Key: YNLCVAQJIKOXER-UHFFFAOYSA-N Synonym: taps,3-1,3-dihydroxy-2-hydroxymethyl propan-2-yl amino propane-1-sulfonic acid,unii-y5dc3in066,n-tris hydroxymethyl methyl-3-aminopropanesulfonic acid,2-hydroxy-1,1-bis hydroxymethyl ethyl amino-1-propanesulfonic acid,3-2-hydroxy-1,1-bis hydroxymethyl ethyl amino-1-propanesulfonic acid,taps buffer,1-propanesulfonic acid, 3-2-hydroxy-1,1-bis hydroxymethyl ethyl amino PubChem CID: 121591 IUPAC Name: 3-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]propane-1-sulfonic acid SMILES: OCC(CO)(CO)NCCCS(O)(=O)=O
| PubChem CID | 121591 |
|---|---|
| CAS | 29915-38-6 |
| Molecular Weight (g/mol) | 243.27 |
| MDL Number | MFCD00007538 |
| SMILES | OCC(CO)(CO)NCCCS(O)(=O)=O |
| Synonym | taps,3-1,3-dihydroxy-2-hydroxymethyl propan-2-yl amino propane-1-sulfonic acid,unii-y5dc3in066,n-tris hydroxymethyl methyl-3-aminopropanesulfonic acid,2-hydroxy-1,1-bis hydroxymethyl ethyl amino-1-propanesulfonic acid,3-2-hydroxy-1,1-bis hydroxymethyl ethyl amino-1-propanesulfonic acid,taps buffer,1-propanesulfonic acid, 3-2-hydroxy-1,1-bis hydroxymethyl ethyl amino |
| IUPAC Name | 3-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]propane-1-sulfonic acid |
| InChI Key | YNLCVAQJIKOXER-UHFFFAOYSA-N |
| Molecular Formula | C7H17NO6S |
Butyl butyrate, 98%
CAS: 109-21-7 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.21 MDL Number: MFCD00009450 InChI Key: XUPYJHCZDLZNFP-UHFFFAOYSA-N Synonym: butyl butyrate,n-butyl butyrate,butanoic acid, butyl ester,n-butyl butanoate,1-butyl butyrate,butyl butylate,butyric acid butyl ester,n-butyl n-butyrate,butyric acid, butyl ester,butyl n-butyrate PubChem CID: 7983 ChEBI: CHEBI:87429 IUPAC Name: butyl butanoate SMILES: CCCCOC(=O)CCC
| PubChem CID | 7983 |
|---|---|
| CAS | 109-21-7 |
| Molecular Weight (g/mol) | 144.21 |
| ChEBI | CHEBI:87429 |
| MDL Number | MFCD00009450 |
| SMILES | CCCCOC(=O)CCC |
| Synonym | butyl butyrate,n-butyl butyrate,butanoic acid, butyl ester,n-butyl butanoate,1-butyl butyrate,butyl butylate,butyric acid butyl ester,n-butyl n-butyrate,butyric acid, butyl ester,butyl n-butyrate |
| IUPAC Name | butyl butanoate |
| InChI Key | XUPYJHCZDLZNFP-UHFFFAOYSA-N |
| Molecular Formula | C8H16O2 |
Ethyl 2-amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, 99%, Thermo Scientific™
CAS: 4506-71-2 InChI Key: CDYVTVLXEWMCHU-UHFFFAOYSA-N PubChem CID: 78262 IUPAC Name: ethyl 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate SMILES: CCOC(=O)C1=C(SC2=C1CCCC2)N
| PubChem CID | 78262 |
|---|---|
| CAS | 4506-71-2 |
| SMILES | CCOC(=O)C1=C(SC2=C1CCCC2)N |
| IUPAC Name | ethyl 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| InChI Key | CDYVTVLXEWMCHU-UHFFFAOYSA-N |
Methyl 3,3-dimethoxypropionate, 99%
CAS: 7424-91-1 Molecular Formula: C6H12O4 Molecular Weight (g/mol): 148.16 MDL Number: MFCD00010650 InChI Key: SMCVPMKCDDNUCQ-UHFFFAOYSA-N Synonym: methyl 3,3-dimethoxypropionate,3,3-dimethoxypropionic acid methyl ester,methyl3,3-dimethoxypropionate,propanoic acid, 3,3-dimethoxy-, methyl ester,zlchem 282,pubchem20228,acmc-1bdjk,ksc490c4j,methyl 3,3-dimethoxy-propanoate,smcvpmkcddnucq-uhfffaoysa PubChem CID: 81924 IUPAC Name: methyl 3,3-dimethoxypropanoate SMILES: COC(CC(=O)OC)OC
| PubChem CID | 81924 |
|---|---|
| CAS | 7424-91-1 |
| Molecular Weight (g/mol) | 148.16 |
| MDL Number | MFCD00010650 |
| SMILES | COC(CC(=O)OC)OC |
| Synonym | methyl 3,3-dimethoxypropionate,3,3-dimethoxypropionic acid methyl ester,methyl3,3-dimethoxypropionate,propanoic acid, 3,3-dimethoxy-, methyl ester,zlchem 282,pubchem20228,acmc-1bdjk,ksc490c4j,methyl 3,3-dimethoxy-propanoate,smcvpmkcddnucq-uhfffaoysa |
| IUPAC Name | methyl 3,3-dimethoxypropanoate |
| InChI Key | SMCVPMKCDDNUCQ-UHFFFAOYSA-N |
| Molecular Formula | C6H12O4 |
2-Bromoacetamide, 98%
CAS: 683-57-8 Molecular Formula: C2H4BrNO Molecular Weight (g/mol): 137.96 MDL Number: MFCD00008025 InChI Key: JUIKUQOUMZUFQT-UHFFFAOYSA-N Synonym: bromoacetamide,acetamide, 2-bromo,2-bromo-acetamide,alpha-bromoacetamide,bromacetamide,bromoacetoamide,bromo acetamide,2-bromoacetoamide,2-bromo acetamide,sjyhcabiktp@ PubChem CID: 69632 IUPAC Name: 2-bromoacetamide SMILES: C(C(=O)N)Br
| PubChem CID | 69632 |
|---|---|
| CAS | 683-57-8 |
| Molecular Weight (g/mol) | 137.96 |
| MDL Number | MFCD00008025 |
| SMILES | C(C(=O)N)Br |
| Synonym | bromoacetamide,acetamide, 2-bromo,2-bromo-acetamide,alpha-bromoacetamide,bromacetamide,bromoacetoamide,bromo acetamide,2-bromoacetoamide,2-bromo acetamide,sjyhcabiktp@ |
| IUPAC Name | 2-bromoacetamide |
| InChI Key | JUIKUQOUMZUFQT-UHFFFAOYSA-N |
| Molecular Formula | C2H4BrNO |
1-Decylboronic acid, 98%
CAS: 24464-63-9 Molecular Formula: C10H23BO2 Molecular Weight (g/mol): 186.102 MDL Number: MFCD01074638 InChI Key: TUTSEMMBKGBUGD-UHFFFAOYSA-N Synonym: n-decylboronic acid,boronic acid, decyl,decylboranic acid,n-decaneboronic acid,n-,boronicacid, b-decyl,1-decylboronic acid,ksc199m8d PubChem CID: 4186635 IUPAC Name: decylboronic acid SMILES: B(CCCCCCCCCC)(O)O
| PubChem CID | 4186635 |
|---|---|
| CAS | 24464-63-9 |
| Molecular Weight (g/mol) | 186.102 |
| MDL Number | MFCD01074638 |
| SMILES | B(CCCCCCCCCC)(O)O |
| Synonym | n-decylboronic acid,boronic acid, decyl,decylboranic acid,n-decaneboronic acid,n-,boronicacid, b-decyl,1-decylboronic acid,ksc199m8d |
| IUPAC Name | decylboronic acid |
| InChI Key | TUTSEMMBKGBUGD-UHFFFAOYSA-N |
| Molecular Formula | C10H23BO2 |
Methanephosphonic acid, 98%, Thermo Scientific Chemicals
CAS: 993-13-5 Molecular Formula: CH5O3P Molecular Weight (g/mol): 96.02 MDL Number: MFCD00002137 InChI Key: YACKEPLHDIMKIO-UHFFFAOYSA-N Synonym: methanephosphonic acid,phosphonic acid, methyl,methyl phosphonic acid,unii-329w4ym10z,phosphonomethyl group,ester group,phosphonomethyl,acmc-20ake9,d02fxw,methylphosphonic acid PubChem CID: 13818 ChEBI: CHEBI:45129 IUPAC Name: methylphosphonic acid SMILES: CP(O)(O)=O
| PubChem CID | 13818 |
|---|---|
| CAS | 993-13-5 |
| Molecular Weight (g/mol) | 96.02 |
| ChEBI | CHEBI:45129 |
| MDL Number | MFCD00002137 |
| SMILES | CP(O)(O)=O |
| Synonym | methanephosphonic acid,phosphonic acid, methyl,methyl phosphonic acid,unii-329w4ym10z,phosphonomethyl group,ester group,phosphonomethyl,acmc-20ake9,d02fxw,methylphosphonic acid |
| IUPAC Name | methylphosphonic acid |
| InChI Key | YACKEPLHDIMKIO-UHFFFAOYSA-N |
| Molecular Formula | CH5O3P |
n-Butyl phosphate, mixture of mono-n-butyl and di-n-butyl
CAS: 52933-01-4 Molecular Formula: C4H11O4P Molecular Weight (g/mol): 154.102 MDL Number: MFCD00013947 InChI Key: BNMJSBUIDQYHIN-UHFFFAOYSA-N Synonym: n-butylphosphate,monobutyl phosphate,phosphoric acid, monobutyl ester,butyl diacid phosphate,n-butyl acid phosphate,butyl dibasic acid phosphate,unii-0i9w48e53l,butyl phosphate, buo ho 2po,mono-n-butylphosphoric acid,butoxyphosphonic acid PubChem CID: 15389 IUPAC Name: butyl dihydrogen phosphate SMILES: CCCCOP(=O)(O)O
| PubChem CID | 15389 |
|---|---|
| CAS | 52933-01-4 |
| Molecular Weight (g/mol) | 154.102 |
| MDL Number | MFCD00013947 |
| SMILES | CCCCOP(=O)(O)O |
| Synonym | n-butylphosphate,monobutyl phosphate,phosphoric acid, monobutyl ester,butyl diacid phosphate,n-butyl acid phosphate,butyl dibasic acid phosphate,unii-0i9w48e53l,butyl phosphate, buo ho 2po,mono-n-butylphosphoric acid,butoxyphosphonic acid |
| IUPAC Name | butyl dihydrogen phosphate |
| InChI Key | BNMJSBUIDQYHIN-UHFFFAOYSA-N |
| Molecular Formula | C4H11O4P |
Sodium L-(+)-tartrate dihydrate, 99%
CAS: 6106-24-7 Molecular Formula: C4H8Na2O8 Molecular Weight (g/mol): 230.08 MDL Number: MFCD00150035 InChI Key: FGJLAJMGHXGFDE-UDMGOBQRNA-L Synonym: unii-dia7c37aow,disodium tartrate dihydrate,disodium l-+-tartrate dihydrate,dia7c37aow,disodium +-tartrate dihydrate,sodium l-+-tartrate dihydrate,butanedioic acid, 2,3-dihydroxy-2r,3r-, disodium salt, dihydrate,disodium tartarate dihydrate,sodium tartrate nf,sodium tartrate dihydrate mi PubChem CID: 131855972 IUPAC Name: (2R,3R)-2,3-dihydroxybutanedioic acid;sodium;dihydrate SMILES: O.O.[Na+].[Na+].O[C@H]([C@@H](O)C([O-])=O)C([O-])=O
| PubChem CID | 131855972 |
|---|---|
| CAS | 6106-24-7 |
| Molecular Weight (g/mol) | 230.08 |
| MDL Number | MFCD00150035 |
| SMILES | O.O.[Na+].[Na+].O[C@H]([C@@H](O)C([O-])=O)C([O-])=O |
| Synonym | unii-dia7c37aow,disodium tartrate dihydrate,disodium l-+-tartrate dihydrate,dia7c37aow,disodium +-tartrate dihydrate,sodium l-+-tartrate dihydrate,butanedioic acid, 2,3-dihydroxy-2r,3r-, disodium salt, dihydrate,disodium tartarate dihydrate,sodium tartrate nf,sodium tartrate dihydrate mi |
| IUPAC Name | (2R,3R)-2,3-dihydroxybutanedioic acid;sodium;dihydrate |
| InChI Key | FGJLAJMGHXGFDE-UDMGOBQRNA-L |
| Molecular Formula | C4H8Na2O8 |
1-Butylphosphonic acid, 98%
CAS: 3321-64-0 Molecular Formula: C4H11O3P Molecular Weight (g/mol): 138.10 MDL Number: MFCD00012295 InChI Key: UOKRBSXOBUKDGE-UHFFFAOYSA-N Synonym: n-butylphosphonic acid,1-butanephosphonic acid,butylphosphonate,1-butylphosphonic acid,phosphonic acid, butyl,n-butyl phosphonic acid,acmc-1cr41 PubChem CID: 76839 ChEBI: CHEBI:41384 IUPAC Name: butylphosphonic acid SMILES: CCCCP(O)(O)=O
| PubChem CID | 76839 |
|---|---|
| CAS | 3321-64-0 |
| Molecular Weight (g/mol) | 138.10 |
| ChEBI | CHEBI:41384 |
| MDL Number | MFCD00012295 |
| SMILES | CCCCP(O)(O)=O |
| Synonym | n-butylphosphonic acid,1-butanephosphonic acid,butylphosphonate,1-butylphosphonic acid,phosphonic acid, butyl,n-butyl phosphonic acid,acmc-1cr41 |
| IUPAC Name | butylphosphonic acid |
| InChI Key | UOKRBSXOBUKDGE-UHFFFAOYSA-N |
| Molecular Formula | C4H11O3P |
Diethyl (4-nitrobenzyl)phosphonate, 98%
CAS: 2609-49-6 Molecular Formula: C11H16NO5P Molecular Weight (g/mol): 273.22 MDL Number: MFCD00047747 InChI Key: FORMFFDDQMCTCT-UHFFFAOYSA-N 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) | 273.22 |
| MDL Number | MFCD00047747 |
| SMILES | CCOP(=O)(CC1=CC=C(C=C1)[N+](=O)[O-])OCC |
| IUPAC Name | 1-(diethoxyphosphorylmethyl)-4-nitrobenzene |
| InChI Key | FORMFFDDQMCTCT-UHFFFAOYSA-N |
| Molecular Formula | C11H16NO5P |