Organic compounds
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Sodium 2-Naphthol-7-sulfonate Hydrate 98.0+%, TCI America™
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CAS: 135-55-7 Molecular Formula: C10H7NaO4S Molecular Weight (g/mol): 246.212 MDL Number: MFCD00021625 InChI Key: IVXSQYUPCUOMRV-UHFFFAOYSA-M Synonym: Cassella′Cs Acid Sodium Salt, F Acid Sodium Salt, 7-Hydroxy-2-naphthalenesulfonic Acid Sodium Salt, Sodium 7-Hydroxy-2-naphthalenesulfonate, 2-Naphthol-7-sulfonic Acid Sodium Salt PubChem CID: 23667647 IUPAC Name: sodium;7-hydroxynaphthalene-2-sulfonate SMILES: C1=CC(=CC2=C1C=CC(=C2)S(=O)(=O)[O-])O.[Na+]
| PubChem CID | 23667647 |
|---|---|
| CAS | 135-55-7 |
| Molecular Weight (g/mol) | 246.212 |
| MDL Number | MFCD00021625 |
| SMILES | C1=CC(=CC2=C1C=CC(=C2)S(=O)(=O)[O-])O.[Na+] |
| Synonym | Cassella′Cs Acid Sodium Salt, F Acid Sodium Salt, 7-Hydroxy-2-naphthalenesulfonic Acid Sodium Salt, Sodium 7-Hydroxy-2-naphthalenesulfonate, 2-Naphthol-7-sulfonic Acid Sodium Salt |
| IUPAC Name | sodium;7-hydroxynaphthalene-2-sulfonate |
| InChI Key | IVXSQYUPCUOMRV-UHFFFAOYSA-M |
| Molecular Formula | C10H7NaO4S |
5,10,15,20-Tetrakis(3,5-dihydroxyphenyl)porphyrin 90.0+%, TCI America™
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CAS: 145764-54-1 Molecular Formula: C44H30N4O8 Molecular Weight (g/mol): 742.744 MDL Number: MFCD02093497 InChI Key: XDVQXKKXBXLGCO-UHFFFAOYSA-N Synonym: 5,10,15,20-Tetrakis(3,5-dihydroxyphenyl)-21H,23H-porphine PubChem CID: 471968 IUPAC Name: 5-[10,15,20-tris(3,5-dihydroxyphenyl)-21,24-dihydroporphyrin-5-yl]benzene-1,3-diol SMILES: C1=CC2=C(C3=CC=C(N3)C(=C4C=CC(=N4)C(=C5C=CC(=N5)C(=C1N2)C6=CC(=CC(=C6)O)O)C7=CC(=CC(=C7)O)O)C8=CC(=CC(=C8)O)O)C9=CC(=CC(=C9)O)O
| PubChem CID | 471968 |
|---|---|
| CAS | 145764-54-1 |
| Molecular Weight (g/mol) | 742.744 |
| MDL Number | MFCD02093497 |
| SMILES | C1=CC2=C(C3=CC=C(N3)C(=C4C=CC(=N4)C(=C5C=CC(=N5)C(=C1N2)C6=CC(=CC(=C6)O)O)C7=CC(=CC(=C7)O)O)C8=CC(=CC(=C8)O)O)C9=CC(=CC(=C9)O)O |
| Synonym | 5,10,15,20-Tetrakis(3,5-dihydroxyphenyl)-21H,23H-porphine |
| IUPAC Name | 5-[10,15,20-tris(3,5-dihydroxyphenyl)-21,24-dihydroporphyrin-5-yl]benzene-1,3-diol |
| InChI Key | XDVQXKKXBXLGCO-UHFFFAOYSA-N |
| Molecular Formula | C44H30N4O8 |
1-Methyl-4-piperidone Oxime Hydrochloride 97.0+%, TCI America™
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CAS: 84540-61-4 Molecular Formula: C6H13ClN2O Molecular Weight (g/mol): 164.633 MDL Number: MFCD00060190 InChI Key: WQVZFAGWTNLHSX-UHFFFAOYSA-N PubChem CID: 16263136 IUPAC Name: N-(1-methylpiperidin-4-ylidene)hydroxylamine;hydrochloride SMILES: CN1CCC(=NO)CC1.Cl
| PubChem CID | 16263136 |
|---|---|
| CAS | 84540-61-4 |
| Molecular Weight (g/mol) | 164.633 |
| MDL Number | MFCD00060190 |
| SMILES | CN1CCC(=NO)CC1.Cl |
| IUPAC Name | N-(1-methylpiperidin-4-ylidene)hydroxylamine;hydrochloride |
| InChI Key | WQVZFAGWTNLHSX-UHFFFAOYSA-N |
| Molecular Formula | C6H13ClN2O |
2,6-Dibromo-4-nitrophenol 98.0+%, TCI America™
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CAS: 99-28-5 Molecular Formula: C6H3Br2NO3 Molecular Weight (g/mol): 296.902 MDL Number: MFCD00007334 InChI Key: WBHYZUAQCSHXCT-UHFFFAOYSA-N Synonym: 2,6-dibromo-4-nitrophenol,phenol, 2,6-dibromo-4-nitro,4-nitro-2,6-dibromophenol,2,6-dibromo-4-nitro-phenol,pubchem3863,acmc-209sc6,wln: wnr dq ce ee,phenol,6-dibromo-4-nitro,4-06-00-01366 beilstein handbook reference,2,6-dibromo-4-nitro-phenolate PubChem CID: 7429 SMILES: C1=C(C=C(C(=C1Br)O)Br)[N+](=O)[O-]
| PubChem CID | 7429 |
|---|---|
| CAS | 99-28-5 |
| Molecular Weight (g/mol) | 296.902 |
| MDL Number | MFCD00007334 |
| SMILES | C1=C(C=C(C(=C1Br)O)Br)[N+](=O)[O-] |
| Synonym | 2,6-dibromo-4-nitrophenol,phenol, 2,6-dibromo-4-nitro,4-nitro-2,6-dibromophenol,2,6-dibromo-4-nitro-phenol,pubchem3863,acmc-209sc6,wln: wnr dq ce ee,phenol,6-dibromo-4-nitro,4-06-00-01366 beilstein handbook reference,2,6-dibromo-4-nitro-phenolate |
| InChI Key | WBHYZUAQCSHXCT-UHFFFAOYSA-N |
| Molecular Formula | C6H3Br2NO3 |
Thiomalic Acid 98.0+%, TCI America™
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CAS: 70-49-5 Molecular Formula: C4H6O4S Molecular Weight (g/mol): 150.148 MDL Number: MFCD00004860 InChI Key: NJRXVEJTAYWCQJ-UHFFFAOYSA-N Synonym: mercaptosuccinic acid,thiomalic acid,2-thiomalic acid,2-mercaptosuccinic acid,monomercaptosuccinic acid,butanedioic acid, mercapto,malic acid, 2-thio,mercaptosuccinate,2-sulfanylsuccinic acid,dl-mercaptosuccinic acid PubChem CID: 6268 ChEBI: CHEBI:38705 IUPAC Name: 2-sulfanylbutanedioic acid SMILES: C(C(C(=O)O)S)C(=O)O
| PubChem CID | 6268 |
|---|---|
| CAS | 70-49-5 |
| Molecular Weight (g/mol) | 150.148 |
| ChEBI | CHEBI:38705 |
| MDL Number | MFCD00004860 |
| SMILES | C(C(C(=O)O)S)C(=O)O |
| Synonym | mercaptosuccinic acid,thiomalic acid,2-thiomalic acid,2-mercaptosuccinic acid,monomercaptosuccinic acid,butanedioic acid, mercapto,malic acid, 2-thio,mercaptosuccinate,2-sulfanylsuccinic acid,dl-mercaptosuccinic acid |
| IUPAC Name | 2-sulfanylbutanedioic acid |
| InChI Key | NJRXVEJTAYWCQJ-UHFFFAOYSA-N |
| Molecular Formula | C4H6O4S |
3-Methoxybenzylamine 98.0+%, TCI America™
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CAS: 5071-96-5 Molecular Formula: C8H11NO Molecular Weight (g/mol): 137.18 MDL Number: MFCD00008115 InChI Key: GRRIMVWABNHKBX-UHFFFAOYSA-N Synonym: 3-methoxybenzylamine,m-methoxybenzylamine,3-methoxyphenyl methanamine,1-3-methoxyphenyl methanamine,benzenemethanamine, 3-methoxy,3-methoxyphenyl methylamine,benzylamine, m-methoxy,methoxybenzylamine, 3,benzenemethanamine, 3-methoxy-9ci,sz4 PubChem CID: 21156 IUPAC Name: 1-(3-methoxyphenyl)methanamine SMILES: COC1=CC=CC(CN)=C1
| PubChem CID | 21156 |
|---|---|
| CAS | 5071-96-5 |
| Molecular Weight (g/mol) | 137.18 |
| MDL Number | MFCD00008115 |
| SMILES | COC1=CC=CC(CN)=C1 |
| Synonym | 3-methoxybenzylamine,m-methoxybenzylamine,3-methoxyphenyl methanamine,1-3-methoxyphenyl methanamine,benzenemethanamine, 3-methoxy,3-methoxyphenyl methylamine,benzylamine, m-methoxy,methoxybenzylamine, 3,benzenemethanamine, 3-methoxy-9ci,sz4 |
| IUPAC Name | 1-(3-methoxyphenyl)methanamine |
| InChI Key | GRRIMVWABNHKBX-UHFFFAOYSA-N |
| Molecular Formula | C8H11NO |
1,5-Dibromo-2,6-dihydroxynaphthalene 98.0+%, TCI America™
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CAS: 132178-78-0 Molecular Formula: C10H6Br2O2 Molecular Weight (g/mol): 317.96 MDL Number: MFCD16251539 InChI Key: COJNHIANORGBGY-UHFFFAOYSA-N Synonym: 1,5-Dibromo-2,6-naphthalenediol PubChem CID: 14896989 IUPAC Name: 1,5-dibromonaphthalene-2,6-diol SMILES: OC1=CC=C2C(Br)=C(O)C=CC2=C1Br
| PubChem CID | 14896989 |
|---|---|
| CAS | 132178-78-0 |
| Molecular Weight (g/mol) | 317.96 |
| MDL Number | MFCD16251539 |
| SMILES | OC1=CC=C2C(Br)=C(O)C=CC2=C1Br |
| Synonym | 1,5-Dibromo-2,6-naphthalenediol |
| IUPAC Name | 1,5-dibromonaphthalene-2,6-diol |
| InChI Key | COJNHIANORGBGY-UHFFFAOYSA-N |
| Molecular Formula | C10H6Br2O2 |
2-Ethoxybenzylamine 97.0+%, TCI America™
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CAS: 37806-29-4 Molecular Formula: C9H13NO Molecular Weight (g/mol): 151.209 MDL Number: MFCD00008111 InChI Key: LAUPTNYHVCVPFH-UHFFFAOYSA-N Synonym: (2-Ethoxyphenyl)methanamine PubChem CID: 123465 IUPAC Name: (2-ethoxyphenyl)methanamine SMILES: CCOC1=CC=CC=C1CN
| PubChem CID | 123465 |
|---|---|
| CAS | 37806-29-4 |
| Molecular Weight (g/mol) | 151.209 |
| MDL Number | MFCD00008111 |
| SMILES | CCOC1=CC=CC=C1CN |
| Synonym | (2-Ethoxyphenyl)methanamine |
| IUPAC Name | (2-ethoxyphenyl)methanamine |
| InChI Key | LAUPTNYHVCVPFH-UHFFFAOYSA-N |
| Molecular Formula | C9H13NO |
1-Ethyl-3-methylpyrazole-5-carboxylic Acid 98.0+%, TCI America™
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CAS: 50920-65-5 Molecular Formula: C7H10N2O2 Molecular Weight (g/mol): 154.169 MDL Number: MFCD00156147 InChI Key: VFMGOJUUTAPPDA-UHFFFAOYSA-N Synonym: 1-ethyl-3-methyl-1h-pyrazole-5-carboxylic acid,1-ethyl-3-methylpyrazole-5-carboxylic acid,2-ethyl-5-methyl-2h-pyrazole-3-carboxylic acid,1h-pyrazole-5-carboxylic acid, 1-ethyl-3-methyl,maybridge1_008579,acmc-20aovb,1-ethyl-3-methyl-1h-pyrazole-5-carboxylicacid,1-ethyl-3-methylpyrazole-5-carboxylic,1h-pyrazole-5-carboxylicacid, 1-ethyl-3-methyl PubChem CID: 2743794 IUPAC Name: 2-ethyl-5-methylpyrazole-3-carboxylic acid SMILES: CCN1C(=CC(=N1)C)C(=O)O
| PubChem CID | 2743794 |
|---|---|
| CAS | 50920-65-5 |
| Molecular Weight (g/mol) | 154.169 |
| MDL Number | MFCD00156147 |
| SMILES | CCN1C(=CC(=N1)C)C(=O)O |
| Synonym | 1-ethyl-3-methyl-1h-pyrazole-5-carboxylic acid,1-ethyl-3-methylpyrazole-5-carboxylic acid,2-ethyl-5-methyl-2h-pyrazole-3-carboxylic acid,1h-pyrazole-5-carboxylic acid, 1-ethyl-3-methyl,maybridge1_008579,acmc-20aovb,1-ethyl-3-methyl-1h-pyrazole-5-carboxylicacid,1-ethyl-3-methylpyrazole-5-carboxylic,1h-pyrazole-5-carboxylicacid, 1-ethyl-3-methyl |
| IUPAC Name | 2-ethyl-5-methylpyrazole-3-carboxylic acid |
| InChI Key | VFMGOJUUTAPPDA-UHFFFAOYSA-N |
| Molecular Formula | C7H10N2O2 |
1-Ethyl-3,5-difluorobenzene 98.0+%, TCI America™
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CAS: 117358-52-8 Molecular Formula: C8H8F2 Molecular Weight (g/mol): 142.149 MDL Number: MFCD10000628 InChI Key: PFINYKRPUJCMCT-UHFFFAOYSA-N PubChem CID: 20352892 IUPAC Name: 1-ethyl-3,5-difluorobenzene SMILES: CCC1=CC(=CC(=C1)F)F
| PubChem CID | 20352892 |
|---|---|
| CAS | 117358-52-8 |
| Molecular Weight (g/mol) | 142.149 |
| MDL Number | MFCD10000628 |
| SMILES | CCC1=CC(=CC(=C1)F)F |
| IUPAC Name | 1-ethyl-3,5-difluorobenzene |
| InChI Key | PFINYKRPUJCMCT-UHFFFAOYSA-N |
| Molecular Formula | C8H8F2 |
4-Chloro-3-sulfamoylbenzoic Acid 98.0+%, TCI America™
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CAS: 1205-30-7 Molecular Formula: C7H6ClNO4S Molecular Weight (g/mol): 235.638 MDL Number: MFCD00012375 InChI Key: FHQAWINGVCDTTG-UHFFFAOYSA-N Synonym: 4-chloro-5-sulphamoylbenzoic acid,3-aminosulfonyl-4-chlorobenzoic acid,csba,sulfamido-3-chlorobenzoic acid,benzoic acid, 3-aminosulfonyl-4-chloro,3-sulfamoyl-4-chlorobenzoic acid,benzoic acid, 4-chloro-3-sulfamoyl,4-chloro-3-sulfamoyl-benzoic acid,4-chloro-5-sulfamoylbenzoic acid,4-chloro-3-sulphamoylbenzoic acid PubChem CID: 14568 IUPAC Name: 4-chloro-3-sulfamoylbenzoic acid SMILES: C1=CC(=C(C=C1C(=O)O)S(=O)(=O)N)Cl
| PubChem CID | 14568 |
|---|---|
| CAS | 1205-30-7 |
| Molecular Weight (g/mol) | 235.638 |
| MDL Number | MFCD00012375 |
| SMILES | C1=CC(=C(C=C1C(=O)O)S(=O)(=O)N)Cl |
| Synonym | 4-chloro-5-sulphamoylbenzoic acid,3-aminosulfonyl-4-chlorobenzoic acid,csba,sulfamido-3-chlorobenzoic acid,benzoic acid, 3-aminosulfonyl-4-chloro,3-sulfamoyl-4-chlorobenzoic acid,benzoic acid, 4-chloro-3-sulfamoyl,4-chloro-3-sulfamoyl-benzoic acid,4-chloro-5-sulfamoylbenzoic acid,4-chloro-3-sulphamoylbenzoic acid |
| IUPAC Name | 4-chloro-3-sulfamoylbenzoic acid |
| InChI Key | FHQAWINGVCDTTG-UHFFFAOYSA-N |
| Molecular Formula | C7H6ClNO4S |
Pentabromobenzyl Acrylate 98.0+%, TCI America™
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CAS: 59447-55-1 Molecular Formula: C10H5Br5O2 Molecular Weight (g/mol): 556.668 MDL Number: MFCD00804467 InChI Key: GRKDVZMVHOLESV-UHFFFAOYSA-N Synonym: Acrylic Acid Pentabromobenzyl Ester PubChem CID: 101059 IUPAC Name: (2,3,4,5,6-pentabromophenyl)methyl prop-2-enoate SMILES: C=CC(=O)OCC1=C(C(=C(C(=C1Br)Br)Br)Br)Br
| PubChem CID | 101059 |
|---|---|
| CAS | 59447-55-1 |
| Molecular Weight (g/mol) | 556.668 |
| MDL Number | MFCD00804467 |
| SMILES | C=CC(=O)OCC1=C(C(=C(C(=C1Br)Br)Br)Br)Br |
| Synonym | Acrylic Acid Pentabromobenzyl Ester |
| IUPAC Name | (2,3,4,5,6-pentabromophenyl)methyl prop-2-enoate |
| InChI Key | GRKDVZMVHOLESV-UHFFFAOYSA-N |
| Molecular Formula | C10H5Br5O2 |
2-Chloro-6-fluorobenzoyl Chloride 98.0+%, TCI America™
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CAS: 79455-63-3 Molecular Formula: C7H3Cl2FO Molecular Weight (g/mol): 192.998 MDL Number: MFCD00178746 InChI Key: GFNAJZAKJGKJCS-UHFFFAOYSA-N Synonym: 2-chloro-6-fluorobenzoylchloride,2-chloro-6-fluorobenzene-1-carbonyl chloride,2-chloro-6-fluoro-benzoyl chloride,6-chloro-2-fluorobenzoyl chloride,benzoyl chloride, 2-chloro-6-fluoro,acmc-1behg,2-fluoro-6-chlorobenzoyl chloride,attercop-chm at108371,2-chloro-6-fluoro benzoyl chloride,2-chloranyl-6-fluoranyl-benzoyl chloride PubChem CID: 2736547 IUPAC Name: 2-chloro-6-fluorobenzoyl chloride SMILES: C1=CC(=C(C(=C1)Cl)C(=O)Cl)F
| PubChem CID | 2736547 |
|---|---|
| CAS | 79455-63-3 |
| Molecular Weight (g/mol) | 192.998 |
| MDL Number | MFCD00178746 |
| SMILES | C1=CC(=C(C(=C1)Cl)C(=O)Cl)F |
| Synonym | 2-chloro-6-fluorobenzoylchloride,2-chloro-6-fluorobenzene-1-carbonyl chloride,2-chloro-6-fluoro-benzoyl chloride,6-chloro-2-fluorobenzoyl chloride,benzoyl chloride, 2-chloro-6-fluoro,acmc-1behg,2-fluoro-6-chlorobenzoyl chloride,attercop-chm at108371,2-chloro-6-fluoro benzoyl chloride,2-chloranyl-6-fluoranyl-benzoyl chloride |
| IUPAC Name | 2-chloro-6-fluorobenzoyl chloride |
| InChI Key | GFNAJZAKJGKJCS-UHFFFAOYSA-N |
| Molecular Formula | C7H3Cl2FO |
Molindone Hydrochloride 98.0+%, TCI America™
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CAS: 15622-65-8 Molecular Formula: C16H25ClN2O2 Molecular Weight (g/mol): 312.84 MDL Number: MFCD01718304 InChI Key: GQWNECFJGBQMBO-UHFFFAOYNA-N Synonym: 3-Ethyl-6,7-dihydro-2-methyl-5-(morpholinomethyl)-1H-indol-4(5H)-one Hydrochloride, 3-Ethyl-1,5,6,7-tetrahydro-2-methyl-5-(4-morpholinylmethyl)-4H-indol-4-one Hydrochloride PubChem CID: 9883259 IUPAC Name: 4-[(3-ethyl-2-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indol-5-yl)methyl]morpholin-4-ium chloride SMILES: [Cl-].CCC1=C(C)NC2=C1C(=O)C(C[NH+]1CCOCC1)CC2
| PubChem CID | 9883259 |
|---|---|
| CAS | 15622-65-8 |
| Molecular Weight (g/mol) | 312.84 |
| MDL Number | MFCD01718304 |
| SMILES | [Cl-].CCC1=C(C)NC2=C1C(=O)C(C[NH+]1CCOCC1)CC2 |
| Synonym | 3-Ethyl-6,7-dihydro-2-methyl-5-(morpholinomethyl)-1H-indol-4(5H)-one Hydrochloride, 3-Ethyl-1,5,6,7-tetrahydro-2-methyl-5-(4-morpholinylmethyl)-4H-indol-4-one Hydrochloride |
| IUPAC Name | 4-[(3-ethyl-2-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indol-5-yl)methyl]morpholin-4-ium chloride |
| InChI Key | GQWNECFJGBQMBO-UHFFFAOYNA-N |
| Molecular Formula | C16H25ClN2O2 |
Ethylene Glycol 1,2-Bis(2-propynyl) Ether 97.0+%, TCI America™
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CAS: 40842-04-4 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.166 InChI Key: RNHWCSPBGKGOLM-UHFFFAOYSA-N Synonym: 1,2-Bis(2-propynyloxy)ethane, 4,7-Dioxa-1,9-decadiyne PubChem CID: 11083951 IUPAC Name: 3-(2-prop-2-ynoxyethoxy)prop-1-yne SMILES: C#CCOCCOCC#C
| PubChem CID | 11083951 |
|---|---|
| CAS | 40842-04-4 |
| Molecular Weight (g/mol) | 138.166 |
| SMILES | C#CCOCCOCC#C |
| Synonym | 1,2-Bis(2-propynyloxy)ethane, 4,7-Dioxa-1,9-decadiyne |
| IUPAC Name | 3-(2-prop-2-ynoxyethoxy)prop-1-yne |
| InChI Key | RNHWCSPBGKGOLM-UHFFFAOYSA-N |
| Molecular Formula | C8H10O2 |