Organic acids and derivatives
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4-Methyl-1-naphthaleneboronic Acid (contains varying amounts of Anhydride), TCI America™
CAS: 103986-53-4 Molecular Formula: C11H11BO2 Molecular Weight (g/mol): 186.02 MDL Number: MFCD01632204 InChI Key: JHVQEUGNYSVSDH-UHFFFAOYSA-N PubChem CID: 2773511 IUPAC Name: (4-methylnaphthalen-1-yl)boronic acid SMILES: CC1=CC=C(B(O)O)C2=CC=CC=C12
| PubChem CID | 2773511 |
|---|---|
| CAS | 103986-53-4 |
| Molecular Weight (g/mol) | 186.02 |
| MDL Number | MFCD01632204 |
| SMILES | CC1=CC=C(B(O)O)C2=CC=CC=C12 |
| IUPAC Name | (4-methylnaphthalen-1-yl)boronic acid |
| InChI Key | JHVQEUGNYSVSDH-UHFFFAOYSA-N |
| Molecular Formula | C11H11BO2 |
1,1,3,3-Tetraethylurea 99.0+%, TCI America™
CAS: 1187-03-7 Molecular Formula: C9H20N2O Molecular Weight (g/mol): 172.272 MDL Number: MFCD00042881 InChI Key: UWHSPZZUAYSGTB-UHFFFAOYSA-N Synonym: tetraethylurea,urea, tetraethyl,n,n,n',n'-tetraethylurea,unii-w511x6rp5r,urea, 1,1,3,3-tetraethyl,urea, n,n,n',n'-tetraethyl,teu,tetraethyl-urea,urea,tetraethyl,1,1,3,3-tetraethyl-ure PubChem CID: 14465 IUPAC Name: 1,1,3,3-tetraethylurea SMILES: CCN(CC)C(=O)N(CC)CC
| PubChem CID | 14465 |
|---|---|
| CAS | 1187-03-7 |
| Molecular Weight (g/mol) | 172.272 |
| MDL Number | MFCD00042881 |
| SMILES | CCN(CC)C(=O)N(CC)CC |
| Synonym | tetraethylurea,urea, tetraethyl,n,n,n',n'-tetraethylurea,unii-w511x6rp5r,urea, 1,1,3,3-tetraethyl,urea, n,n,n',n'-tetraethyl,teu,tetraethyl-urea,urea,tetraethyl,1,1,3,3-tetraethyl-ure |
| IUPAC Name | 1,1,3,3-tetraethylurea |
| InChI Key | UWHSPZZUAYSGTB-UHFFFAOYSA-N |
| Molecular Formula | C9H20N2O |
Cromolyn Disodium Salt Hydrate, TCI America™
CAS: 15826-37-6 Molecular Formula: C23H14Na2O11 Molecular Weight (g/mol): 512.33 MDL Number: MFCD00057744 InChI Key: VLARUOGDXDTHEH-UHFFFAOYSA-L Synonym: cromolyn sodium,sodium cromoglycate,disodium cromoglycate,sodium cromoglicate,sodium cromolyn,gastrocrom,nasalcrom,cromoglycate disodium,natrium cromoglicat,lomudal PubChem CID: 27503 ChEBI: CHEBI:128458 IUPAC Name: disodium 5-{3-[(2-carboxylato-4-oxo-4H-chromen-5-yl)oxy]-2-hydroxypropoxy}-4-oxo-4H-chromene-2-carboxylate SMILES: [Na+].[Na+].OC(COC1=C2C(=O)C=C(OC2=CC=C1)C([O-])=O)COC1=C2C(=O)C=C(OC2=CC=C1)C([O-])=O
| PubChem CID | 27503 |
|---|---|
| CAS | 15826-37-6 |
| Molecular Weight (g/mol) | 512.33 |
| ChEBI | CHEBI:128458 |
| MDL Number | MFCD00057744 |
| SMILES | [Na+].[Na+].OC(COC1=C2C(=O)C=C(OC2=CC=C1)C([O-])=O)COC1=C2C(=O)C=C(OC2=CC=C1)C([O-])=O |
| Synonym | cromolyn sodium,sodium cromoglycate,disodium cromoglycate,sodium cromoglicate,sodium cromolyn,gastrocrom,nasalcrom,cromoglycate disodium,natrium cromoglicat,lomudal |
| IUPAC Name | disodium 5-{3-[(2-carboxylato-4-oxo-4H-chromen-5-yl)oxy]-2-hydroxypropoxy}-4-oxo-4H-chromene-2-carboxylate |
| InChI Key | VLARUOGDXDTHEH-UHFFFAOYSA-L |
| Molecular Formula | C23H14Na2O11 |
1-Chloroethyl Cyclohexyl Carbonate 98.0+%, TCI America™
CAS: 99464-83-2 Molecular Formula: C9H15ClO3 Molecular Weight (g/mol): 206.666 MDL Number: MFCD04038149 InChI Key: ONZWFHWHTYZZLM-UHFFFAOYSA-N Synonym: Carbonic Acid 1-Chloroethyl Cyclohexyl Ester PubChem CID: 11229529 IUPAC Name: 1-chloroethyl cyclohexyl carbonate SMILES: CC(OC(=O)OC1CCCCC1)Cl
| PubChem CID | 11229529 |
|---|---|
| CAS | 99464-83-2 |
| Molecular Weight (g/mol) | 206.666 |
| MDL Number | MFCD04038149 |
| SMILES | CC(OC(=O)OC1CCCCC1)Cl |
| Synonym | Carbonic Acid 1-Chloroethyl Cyclohexyl Ester |
| IUPAC Name | 1-chloroethyl cyclohexyl carbonate |
| InChI Key | ONZWFHWHTYZZLM-UHFFFAOYSA-N |
| Molecular Formula | C9H15ClO3 |
Isonicotinic Acid Hydrazide 98.0+%, TCI America™
CAS: 54-85-3 Molecular Formula: C6H7N3O Molecular Weight (g/mol): 137.142 MDL Number: MFCD00006426 InChI Key: QRXWMOHMRWLFEY-UHFFFAOYSA-N Synonym: isoniazid,isonicotinic acid hydrazide,isonicotinohydrazide,rimifon,isoniazide,nydrazid,isonicotinic hydrazide,laniazid,isonicotinylhydrazine,andrazide PubChem CID: 3767 ChEBI: CHEBI:6030 IUPAC Name: pyridine-4-carbohydrazide SMILES: C1=CN=CC=C1C(=O)NN
| PubChem CID | 3767 |
|---|---|
| CAS | 54-85-3 |
| Molecular Weight (g/mol) | 137.142 |
| ChEBI | CHEBI:6030 |
| MDL Number | MFCD00006426 |
| SMILES | C1=CN=CC=C1C(=O)NN |
| Synonym | isoniazid,isonicotinic acid hydrazide,isonicotinohydrazide,rimifon,isoniazide,nydrazid,isonicotinic hydrazide,laniazid,isonicotinylhydrazine,andrazide |
| IUPAC Name | pyridine-4-carbohydrazide |
| InChI Key | QRXWMOHMRWLFEY-UHFFFAOYSA-N |
| Molecular Formula | C6H7N3O |
Tricholine Citrate (ca. 65% in Water), TCI America™
CAS: 546-63-4 Molecular Formula: C21H47N3O10 Molecular Weight (g/mol): 501.618 MDL Number: MFCD00059985 InChI Key: RPERJPYDELTDMR-UHFFFAOYSA-K Synonym: Choline Citrate Solution PubChem CID: 11024 IUPAC Name: 2-hydroxyethyl(trimethyl)azanium;2-hydroxypropane-1,2,3-tricarboxylate SMILES: C[N+](C)(C)CCO.C[N+](C)(C)CCO.C[N+](C)(C)CCO.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O
| PubChem CID | 11024 |
|---|---|
| CAS | 546-63-4 |
| Molecular Weight (g/mol) | 501.618 |
| MDL Number | MFCD00059985 |
| SMILES | C[N+](C)(C)CCO.C[N+](C)(C)CCO.C[N+](C)(C)CCO.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O |
| Synonym | Choline Citrate Solution |
| IUPAC Name | 2-hydroxyethyl(trimethyl)azanium;2-hydroxypropane-1,2,3-tricarboxylate |
| InChI Key | RPERJPYDELTDMR-UHFFFAOYSA-K |
| Molecular Formula | C21H47N3O10 |
Methyl 2-(p-Tolyl)benzoate 98.0+%, TCI America™
CAS: 114772-34-8 Molecular Formula: C15H14O2 Molecular Weight (g/mol): 226.28 MDL Number: MFCD03453661 InChI Key: IHNIAWHITVGYJJ-UHFFFAOYSA-N PubChem CID: 1393873 IUPAC Name: methyl 4'-methyl-[1,1'-biphenyl]-2-carboxylate SMILES: COC(=O)C1=CC=CC=C1C1=CC=C(C)C=C1
| PubChem CID | 1393873 |
|---|---|
| CAS | 114772-34-8 |
| Molecular Weight (g/mol) | 226.28 |
| MDL Number | MFCD03453661 |
| SMILES | COC(=O)C1=CC=CC=C1C1=CC=C(C)C=C1 |
| IUPAC Name | methyl 4'-methyl-[1,1'-biphenyl]-2-carboxylate |
| InChI Key | IHNIAWHITVGYJJ-UHFFFAOYSA-N |
| Molecular Formula | C15H14O2 |
N,2'-Dimethylformanilide 97.0+%, TCI America™
CAS: 131840-54-5 Molecular Formula: C9H11NO Molecular Weight (g/mol): 149.19 MDL Number: MFCD09038514 InChI Key: WWWSJNJIEHCOSE-UHFFFAOYSA-N Synonym: N-Methyl-N-(o-tolyl)formamide PubChem CID: 15739199 IUPAC Name: N-methyl-N-(2-methylphenyl)formamide SMILES: CN(C=O)C1=CC=CC=C1C
| PubChem CID | 15739199 |
|---|---|
| CAS | 131840-54-5 |
| Molecular Weight (g/mol) | 149.19 |
| MDL Number | MFCD09038514 |
| SMILES | CN(C=O)C1=CC=CC=C1C |
| Synonym | N-Methyl-N-(o-tolyl)formamide |
| IUPAC Name | N-methyl-N-(2-methylphenyl)formamide |
| InChI Key | WWWSJNJIEHCOSE-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO |
Zaltoprofen 98.0+%, TCI America™
CAS: 74711-43-6 Molecular Formula: C17H14O3S Molecular Weight (g/mol): 298.356 MDL Number: MFCD00864323 InChI Key: MUXFZBHBYYYLTH-UHFFFAOYSA-N Synonym: 2-(10,11-Dihydro-10-oxodibenzo[b,f]thiepin-2-yl)propionic Acid PubChem CID: 5720 IUPAC Name: 2-(6-oxo-5H-benzo[b][1]benzothiepin-3-yl)propanoic acid SMILES: CC(C1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)C2)C(=O)O
| PubChem CID | 5720 |
|---|---|
| CAS | 74711-43-6 |
| Molecular Weight (g/mol) | 298.356 |
| MDL Number | MFCD00864323 |
| SMILES | CC(C1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)C2)C(=O)O |
| Synonym | 2-(10,11-Dihydro-10-oxodibenzo[b,f]thiepin-2-yl)propionic Acid |
| IUPAC Name | 2-(6-oxo-5H-benzo[b][1]benzothiepin-3-yl)propanoic acid |
| InChI Key | MUXFZBHBYYYLTH-UHFFFAOYSA-N |
| Molecular Formula | C17H14O3S |
beta-Methyllevulinic Acid 98.0+%, TCI America™
CAS: 6628-79-1 Molecular Formula: C6H10O3 Molecular Weight (g/mol): 130.143 MDL Number: MFCD00143691 InChI Key: NFIWUVRBASXMGK-UHFFFAOYSA-N Synonym: 3-Acetylbutyric Acid, 3-Methyl-4-oxopentanoic Acid PubChem CID: 246523 IUPAC Name: 3-methyl-4-oxopentanoic acid SMILES: CC(CC(=O)O)C(=O)C
| PubChem CID | 246523 |
|---|---|
| CAS | 6628-79-1 |
| Molecular Weight (g/mol) | 130.143 |
| MDL Number | MFCD00143691 |
| SMILES | CC(CC(=O)O)C(=O)C |
| Synonym | 3-Acetylbutyric Acid, 3-Methyl-4-oxopentanoic Acid |
| IUPAC Name | 3-methyl-4-oxopentanoic acid |
| InChI Key | NFIWUVRBASXMGK-UHFFFAOYSA-N |
| Molecular Formula | C6H10O3 |
Sodium 3-(1-Naphthylamino)propanesulfonate 98.0+%, TCI America™
CAS: 104484-71-1 Molecular Formula: C13H14NNaO3S Molecular Weight (g/mol): 287.309 MDL Number: MFCD00059520 InChI Key: HSOPFPPLFWZKJN-UHFFFAOYSA-M Synonym: sodium 3-naphthalen-1-ylamino propane-1-sulfonate,sodium 3-1-naphthylamino propanesulfonate,n-1-naphthyl-3-aminopropanesulfonic acid sodium salt,sodium 3-1-naphthylamino-1-propanesulfonate,sodium 3-naphthalen-1-yl amino propane-1-sulfonate,1-propanesulfonicacid,3-1-naphthalenylamino-,sodiumsalt 1:1,1-propanesulfonic acid, 3-1-naphthalenylamino-, monosodium salt,ksc909a8j,sodium 3-1-naphthylamino propane-1-sulfonate,n-1-naphthyl-3-aminopropanesulfonic acidsodiumsalt PubChem CID: 23672139 IUPAC Name: sodium;3-(naphthalen-1-ylamino)propane-1-sulfonate SMILES: C1=CC=C2C(=C1)C=CC=C2NCCCS(=O)(=O)[O-].[Na+]
| PubChem CID | 23672139 |
|---|---|
| CAS | 104484-71-1 |
| Molecular Weight (g/mol) | 287.309 |
| MDL Number | MFCD00059520 |
| SMILES | C1=CC=C2C(=C1)C=CC=C2NCCCS(=O)(=O)[O-].[Na+] |
| Synonym | sodium 3-naphthalen-1-ylamino propane-1-sulfonate,sodium 3-1-naphthylamino propanesulfonate,n-1-naphthyl-3-aminopropanesulfonic acid sodium salt,sodium 3-1-naphthylamino-1-propanesulfonate,sodium 3-naphthalen-1-yl amino propane-1-sulfonate,1-propanesulfonicacid,3-1-naphthalenylamino-,sodiumsalt 1:1,1-propanesulfonic acid, 3-1-naphthalenylamino-, monosodium salt,ksc909a8j,sodium 3-1-naphthylamino propane-1-sulfonate,n-1-naphthyl-3-aminopropanesulfonic acidsodiumsalt |
| IUPAC Name | sodium;3-(naphthalen-1-ylamino)propane-1-sulfonate |
| InChI Key | HSOPFPPLFWZKJN-UHFFFAOYSA-M |
| Molecular Formula | C13H14NNaO3S |
Methyl 2-Chloropropionate 95.0+%, TCI America™
CAS: 17639-93-9 Molecular Formula: C4H7ClO2 Molecular Weight (g/mol): 122.55 MDL Number: MFCD00000863 InChI Key: JLEJCNOTNLZCHQ-UHFFFAOYNA-N Synonym: methyl 2-chloropropionate,propanoic acid, 2-chloro-, methyl ester,2-chloropropionic acid methyl ester,propionic acid, 2-chloro-, methyl ester,methyl alpha-chloropropionate,methyl .alpha.-chloropropionate,.alpha.-chloropropionic acid methyl ester,propanoic acid, 2-chloro-, methyl ester, s,ch3chclc o och3,acmc-1bl6f PubChem CID: 28659 IUPAC Name: methyl 2-chloropropanoate SMILES: COC(=O)C(C)Cl
| PubChem CID | 28659 |
|---|---|
| CAS | 17639-93-9 |
| Molecular Weight (g/mol) | 122.55 |
| MDL Number | MFCD00000863 |
| SMILES | COC(=O)C(C)Cl |
| Synonym | methyl 2-chloropropionate,propanoic acid, 2-chloro-, methyl ester,2-chloropropionic acid methyl ester,propionic acid, 2-chloro-, methyl ester,methyl alpha-chloropropionate,methyl .alpha.-chloropropionate,.alpha.-chloropropionic acid methyl ester,propanoic acid, 2-chloro-, methyl ester, s,ch3chclc o och3,acmc-1bl6f |
| IUPAC Name | methyl 2-chloropropanoate |
| InChI Key | JLEJCNOTNLZCHQ-UHFFFAOYNA-N |
| Molecular Formula | C4H7ClO2 |
3-Nitrophenyl p-Toluenesulfonate 98.0+%, TCI America™
CAS: 3899-90-9 Molecular Formula: C13H11NO5S Molecular Weight (g/mol): 293.29 MDL Number: MFCD00060140 InChI Key: QRMMIQVSVATYQP-UHFFFAOYSA-N Synonym: p-Toluenesulfonic Acid 3-Nitrophenyl Ester PubChem CID: 94890 IUPAC Name: 3-nitrophenyl 4-methylbenzene-1-sulfonate SMILES: CC1=CC=C(C=C1)S(=O)(=O)OC1=CC=CC(=C1)[N+]([O-])=O
| PubChem CID | 94890 |
|---|---|
| CAS | 3899-90-9 |
| Molecular Weight (g/mol) | 293.29 |
| MDL Number | MFCD00060140 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC1=CC=CC(=C1)[N+]([O-])=O |
| Synonym | p-Toluenesulfonic Acid 3-Nitrophenyl Ester |
| IUPAC Name | 3-nitrophenyl 4-methylbenzene-1-sulfonate |
| InChI Key | QRMMIQVSVATYQP-UHFFFAOYSA-N |
| Molecular Formula | C13H11NO5S |
Isoamyl Formate 95.0+%, TCI America™
CAS: 110-45-2 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00021049 InChI Key: XKYICAQFSCFURC-UHFFFAOYSA-N Synonym: Formic Acid Isoamyl Ester PubChem CID: 8052 ChEBI: CHEBI:31726 IUPAC Name: 3-methylbutyl formate SMILES: CC(C)CCOC=O
| PubChem CID | 8052 |
|---|---|
| CAS | 110-45-2 |
| Molecular Weight (g/mol) | 116.16 |
| ChEBI | CHEBI:31726 |
| MDL Number | MFCD00021049 |
| SMILES | CC(C)CCOC=O |
| Synonym | Formic Acid Isoamyl Ester |
| IUPAC Name | 3-methylbutyl formate |
| InChI Key | XKYICAQFSCFURC-UHFFFAOYSA-N |
| Molecular Formula | C6H12O2 |
trans-4-Pentylcyclohexanecarboxylic Acid 99.0+%, TCI America™
CAS: 38289-29-1 Molecular Formula: C12H22O2 Molecular Weight (g/mol): 198.306 MDL Number: MFCD00009964 InChI Key: RVLAXPQGTRTHEV-UHFFFAOYSA-N Synonym: trans-4-pentylcyclohexanecarboxylic acid,4-pentylcyclohexanecarboxylic acid,trans-4-n-pentylcyclohexanecarboxylic acid,cyclohexanecarboxylic acid, 4-pentyl,trans-4-amylcyclohexanecarboxylic acid,cyclohexanecarboxylic acid, 4-pentyl-, trans,4-n-pentylcyclohexane carboxylic acid,4-amylcyclohexanecarboxylic acid,rvlaxpqgtrthev-xypyzodxsa-n,1s,4r-4-pentylcyclohexane-1-carboxylic acid PubChem CID: 98882 IUPAC Name: 4-pentylcyclohexane-1-carboxylic acid SMILES: CCCCCC1CCC(CC1)C(=O)O
| PubChem CID | 98882 |
|---|---|
| CAS | 38289-29-1 |
| Molecular Weight (g/mol) | 198.306 |
| MDL Number | MFCD00009964 |
| SMILES | CCCCCC1CCC(CC1)C(=O)O |
| Synonym | trans-4-pentylcyclohexanecarboxylic acid,4-pentylcyclohexanecarboxylic acid,trans-4-n-pentylcyclohexanecarboxylic acid,cyclohexanecarboxylic acid, 4-pentyl,trans-4-amylcyclohexanecarboxylic acid,cyclohexanecarboxylic acid, 4-pentyl-, trans,4-n-pentylcyclohexane carboxylic acid,4-amylcyclohexanecarboxylic acid,rvlaxpqgtrthev-xypyzodxsa-n,1s,4r-4-pentylcyclohexane-1-carboxylic acid |
| IUPAC Name | 4-pentylcyclohexane-1-carboxylic acid |
| InChI Key | RVLAXPQGTRTHEV-UHFFFAOYSA-N |
| Molecular Formula | C12H22O2 |