Benzenoids
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3-Amino-4-chlorobenzotrifluoride 98.0+%, TCI America™
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CAS: 121-50-6 Molecular Formula: C7H5ClF3N Molecular Weight (g/mol): 195.569 MDL Number: MFCD00007673 InChI Key: VKTTYIXIDXWHKW-UHFFFAOYSA-N Synonym: 3-amino-4-chlorobenzotrifluoride,2-chloro-5-trifluoromethyl aniline,fast orange rd oil,fast orange salt rd,orange salt nrd,benzenamine, 2-chloro-5-trifluoromethyl,fast orange rd salt,daito orange salt rd,diazo fast orange rd,fast orange salt rda PubChem CID: 8475 IUPAC Name: 2-chloro-5-(trifluoromethyl)aniline SMILES: C1=CC(=C(C=C1C(F)(F)F)N)Cl
| PubChem CID | 8475 |
|---|---|
| CAS | 121-50-6 |
| Molecular Weight (g/mol) | 195.569 |
| MDL Number | MFCD00007673 |
| SMILES | C1=CC(=C(C=C1C(F)(F)F)N)Cl |
| Synonym | 3-amino-4-chlorobenzotrifluoride,2-chloro-5-trifluoromethyl aniline,fast orange rd oil,fast orange salt rd,orange salt nrd,benzenamine, 2-chloro-5-trifluoromethyl,fast orange rd salt,daito orange salt rd,diazo fast orange rd,fast orange salt rda |
| IUPAC Name | 2-chloro-5-(trifluoromethyl)aniline |
| InChI Key | VKTTYIXIDXWHKW-UHFFFAOYSA-N |
| Molecular Formula | C7H5ClF3N |
2-Chloro-5-nitrobenzotrifluoride 97.0+%, TCI America™
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CAS: 777-37-7 Molecular Formula: C7H3ClF3NO2 Molecular Weight (g/mol): 225.55 MDL Number: MFCD00007296 InChI Key: HQROXDLWVGFPDE-UHFFFAOYSA-N Synonym: 2-chloro-5-nitrobenzotrifluoride,1-chloro-4-nitro-2-trifluoromethyl benzene,4-chloro-3-trifluoromethyl nitrobenzene,benzene, 1-chloro-4-nitro-2-trifluoromethyl,3-trifluoromethyl-4-chloronitrobenzene,2-trifluoromethyl-4-nitrochlorobenzene,2-chloro-5-nitro-a,a,a-trifluorotoluene,4-nitro-2-trifluoromethyl chlorobenzene,1-chloro-2-trifluoromethyl-4-nitrobenzene,5-nitro-2-chlorobenzotrifluoride PubChem CID: 61213 IUPAC Name: 1-chloro-4-nitro-2-(trifluoromethyl)benzene SMILES: [O-][N+](=O)C1=CC=C(Cl)C(=C1)C(F)(F)F
| PubChem CID | 61213 |
|---|---|
| CAS | 777-37-7 |
| Molecular Weight (g/mol) | 225.55 |
| MDL Number | MFCD00007296 |
| SMILES | [O-][N+](=O)C1=CC=C(Cl)C(=C1)C(F)(F)F |
| Synonym | 2-chloro-5-nitrobenzotrifluoride,1-chloro-4-nitro-2-trifluoromethyl benzene,4-chloro-3-trifluoromethyl nitrobenzene,benzene, 1-chloro-4-nitro-2-trifluoromethyl,3-trifluoromethyl-4-chloronitrobenzene,2-trifluoromethyl-4-nitrochlorobenzene,2-chloro-5-nitro-a,a,a-trifluorotoluene,4-nitro-2-trifluoromethyl chlorobenzene,1-chloro-2-trifluoromethyl-4-nitrobenzene,5-nitro-2-chlorobenzotrifluoride |
| IUPAC Name | 1-chloro-4-nitro-2-(trifluoromethyl)benzene |
| InChI Key | HQROXDLWVGFPDE-UHFFFAOYSA-N |
| Molecular Formula | C7H3ClF3NO2 |
Methyl 2-(Bromomethyl)-3-nitrobenzoate 98.0+%, TCI America™
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CAS: 98475-07-1 Molecular Formula: C9H8BrNO4 Molecular Weight (g/mol): 274.07 MDL Number: MFCD04114315 InChI Key: FCGIVHSBEKGQMZ-UHFFFAOYSA-N Synonym: methyl 2-bromomethyl-3-nitrobenzoate,2-bromomethyl-3-nitrobenzoic acid methyl ester,methyl 2-bromomethyl-3-nitro-benzoate,benzoic acid, 2-bromomethyl-3-nitro-, methyl ester,methyl 2-bromomethyl-3-nitrobenzenecarboxylate,2-bromomethyl-3-nitro benzoic acid methyl ester,methyl2-bromomethyl-3-nitrobenzoate,zlchem 474,pubchem19169 PubChem CID: 1487795 IUPAC Name: methyl 2-(bromomethyl)-3-nitrobenzoate SMILES: COC(=O)C1=C(C(=CC=C1)[N+](=O)[O-])CBr
| PubChem CID | 1487795 |
|---|---|
| CAS | 98475-07-1 |
| Molecular Weight (g/mol) | 274.07 |
| MDL Number | MFCD04114315 |
| SMILES | COC(=O)C1=C(C(=CC=C1)[N+](=O)[O-])CBr |
| Synonym | methyl 2-bromomethyl-3-nitrobenzoate,2-bromomethyl-3-nitrobenzoic acid methyl ester,methyl 2-bromomethyl-3-nitro-benzoate,benzoic acid, 2-bromomethyl-3-nitro-, methyl ester,methyl 2-bromomethyl-3-nitrobenzenecarboxylate,2-bromomethyl-3-nitro benzoic acid methyl ester,methyl2-bromomethyl-3-nitrobenzoate,zlchem 474,pubchem19169 |
| IUPAC Name | methyl 2-(bromomethyl)-3-nitrobenzoate |
| InChI Key | FCGIVHSBEKGQMZ-UHFFFAOYSA-N |
| Molecular Formula | C9H8BrNO4 |
5-Bromo-4'-chlorosalicylanilide 98.0+%, TCI America™
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CAS: 3679-64-9 Molecular Formula: C13H9BrClNO2 Molecular Weight (g/mol): 326.57 MDL Number: MFCD00020132 InChI Key: QBSGXIBYUQJHMJ-UHFFFAOYSA-N Synonym: 5-Bromo-4′C-chloro-2-hydroxybenzanilide PubChem CID: 77254 IUPAC Name: 5-bromo-N-(4-chlorophenyl)-2-hydroxybenzamide SMILES: OC1=CC=C(Br)C=C1C(=O)NC1=CC=C(Cl)C=C1
| PubChem CID | 77254 |
|---|---|
| CAS | 3679-64-9 |
| Molecular Weight (g/mol) | 326.57 |
| MDL Number | MFCD00020132 |
| SMILES | OC1=CC=C(Br)C=C1C(=O)NC1=CC=C(Cl)C=C1 |
| Synonym | 5-Bromo-4′C-chloro-2-hydroxybenzanilide |
| IUPAC Name | 5-bromo-N-(4-chlorophenyl)-2-hydroxybenzamide |
| InChI Key | QBSGXIBYUQJHMJ-UHFFFAOYSA-N |
| Molecular Formula | C13H9BrClNO2 |
Diphenyl N-Cyanocarbonimidate 97.0+%, TCI America™
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CAS: 79463-77-7 Molecular Formula: C14H10N2O2 Molecular Weight (g/mol): 238.25 MDL Number: MFCD00010380 InChI Key: SLIKWVTWIGHFJE-UHFFFAOYSA-N Synonym: diphenyl n-cyanocarbonimidate,diphenyl cyanocarbonimidate,diphenoxymethylenecyanamide,n-cyano-diphenyl imidocarbonate,diphenylcyanocarbonimidate,cyanocarbonimidia acid diphenyl aester,n-cyanocarbonimidic acid diphenyl ester,bis phenoxy methylidenecyanamide,cyano diphenoxymethylidene amine,3,3-diphenoxy-2-azaprop-2-enenitrile PubChem CID: 688090 IUPAC Name: cyano(diphenoxymethylidene)amine SMILES: N#CN=C(OC1=CC=CC=C1)OC1=CC=CC=C1
| PubChem CID | 688090 |
|---|---|
| CAS | 79463-77-7 |
| Molecular Weight (g/mol) | 238.25 |
| MDL Number | MFCD00010380 |
| SMILES | N#CN=C(OC1=CC=CC=C1)OC1=CC=CC=C1 |
| Synonym | diphenyl n-cyanocarbonimidate,diphenyl cyanocarbonimidate,diphenoxymethylenecyanamide,n-cyano-diphenyl imidocarbonate,diphenylcyanocarbonimidate,cyanocarbonimidia acid diphenyl aester,n-cyanocarbonimidic acid diphenyl ester,bis phenoxy methylidenecyanamide,cyano diphenoxymethylidene amine,3,3-diphenoxy-2-azaprop-2-enenitrile |
| IUPAC Name | cyano(diphenoxymethylidene)amine |
| InChI Key | SLIKWVTWIGHFJE-UHFFFAOYSA-N |
| Molecular Formula | C14H10N2O2 |
2,3,4-Trifluorophenol 98.0+%, TCI America™
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CAS: 2822-41-5 Molecular Formula: C6H3F3O Molecular Weight (g/mol): 148.084 MDL Number: MFCD00042426 InChI Key: IJGSULQFKYOYEU-UHFFFAOYSA-N PubChem CID: 123174 IUPAC Name: 2,3,4-trifluorophenol SMILES: C1=CC(=C(C(=C1O)F)F)F
| PubChem CID | 123174 |
|---|---|
| CAS | 2822-41-5 |
| Molecular Weight (g/mol) | 148.084 |
| MDL Number | MFCD00042426 |
| SMILES | C1=CC(=C(C(=C1O)F)F)F |
| IUPAC Name | 2,3,4-trifluorophenol |
| InChI Key | IJGSULQFKYOYEU-UHFFFAOYSA-N |
| Molecular Formula | C6H3F3O |
o-Tolylthiourea 98.0+%, TCI America™
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CAS: 614-78-8 Molecular Formula: C8H10N2S Molecular Weight (g/mol): 166.24 MDL Number: MFCD00041162 InChI Key: ACLZYRNSDLQOIA-UHFFFAOYSA-N Synonym: o-tolylthiourea,2-methylphenyl thiourea,n-o-tolyl thiourea,1-2-methylphenyl thiourea,n-2-methylphenyl thiourea,1-2-methylphenyl-2-thiourea,2-tolylthiourea,1-o-tolyl-2-thiourea,thiourea, 2-methylphenyl,1-o-tolyl thiourea PubChem CID: 2787703 IUPAC Name: (2-methylphenyl)thiourea SMILES: CC1=CC=CC=C1NC(N)=S
| PubChem CID | 2787703 |
|---|---|
| CAS | 614-78-8 |
| Molecular Weight (g/mol) | 166.24 |
| MDL Number | MFCD00041162 |
| SMILES | CC1=CC=CC=C1NC(N)=S |
| Synonym | o-tolylthiourea,2-methylphenyl thiourea,n-o-tolyl thiourea,1-2-methylphenyl thiourea,n-2-methylphenyl thiourea,1-2-methylphenyl-2-thiourea,2-tolylthiourea,1-o-tolyl-2-thiourea,thiourea, 2-methylphenyl,1-o-tolyl thiourea |
| IUPAC Name | (2-methylphenyl)thiourea |
| InChI Key | ACLZYRNSDLQOIA-UHFFFAOYSA-N |
| Molecular Formula | C8H10N2S |
4-(4-Propylphenyl)benzoic Acid 98.0+%, TCI America™
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CAS: 88038-94-2 Molecular Formula: C16H16O2 Molecular Weight (g/mol): 240.302 MDL Number: MFCD00017335 InChI Key: HCPBURTZSXRGBN-UHFFFAOYSA-N Synonym: 4-4-propylphenyl benzoic acid,4-4-n-propylphenyl benzoic acid,4'-propyl-1,1'-biphenyl-4-carboxylic acid,4-propylbiphenyl-4'-carboxylic acid,4-propyl-4'-biphenylcarboxylic acid,4'-propylbiphenyl-4-carboxylic acid,4-n-propylbiphenyl-4'-carboxylic acid,4-p-n-propylphenyl benzoic acid,1,1'-biphenyl-4-carboxylic acid, 4'-propyl,4'-n-propylbiphenyl-4-carboxylic acid PubChem CID: 522891 IUPAC Name: 4-(4-propylphenyl)benzoic acid SMILES: CCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O
| PubChem CID | 522891 |
|---|---|
| CAS | 88038-94-2 |
| Molecular Weight (g/mol) | 240.302 |
| MDL Number | MFCD00017335 |
| SMILES | CCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O |
| Synonym | 4-4-propylphenyl benzoic acid,4-4-n-propylphenyl benzoic acid,4'-propyl-1,1'-biphenyl-4-carboxylic acid,4-propylbiphenyl-4'-carboxylic acid,4-propyl-4'-biphenylcarboxylic acid,4'-propylbiphenyl-4-carboxylic acid,4-n-propylbiphenyl-4'-carboxylic acid,4-p-n-propylphenyl benzoic acid,1,1'-biphenyl-4-carboxylic acid, 4'-propyl,4'-n-propylbiphenyl-4-carboxylic acid |
| IUPAC Name | 4-(4-propylphenyl)benzoic acid |
| InChI Key | HCPBURTZSXRGBN-UHFFFAOYSA-N |
| Molecular Formula | C16H16O2 |
4,5-Dibromo-1,2-phenylenediamine 98.0+%, TCI America™
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CAS: 49764-63-8 Molecular Formula: C6H6Br2N2 Molecular Weight (g/mol): 265.94 MDL Number: MFCD00795598 InChI Key: TTXGKCVKGXHPRI-UHFFFAOYSA-N Synonym: 1,2-Diamino-4,5-dibromobenzene PubChem CID: 12196944 IUPAC Name: 4,5-dibromobenzene-1,2-diamine SMILES: NC1=CC(Br)=C(Br)C=C1N
| PubChem CID | 12196944 |
|---|---|
| CAS | 49764-63-8 |
| Molecular Weight (g/mol) | 265.94 |
| MDL Number | MFCD00795598 |
| SMILES | NC1=CC(Br)=C(Br)C=C1N |
| Synonym | 1,2-Diamino-4,5-dibromobenzene |
| IUPAC Name | 4,5-dibromobenzene-1,2-diamine |
| InChI Key | TTXGKCVKGXHPRI-UHFFFAOYSA-N |
| Molecular Formula | C6H6Br2N2 |
1-Bromo-3,5-bis(trifluoromethyl)benzene 98.0+%, TCI America™
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CAS: 328-70-1 Molecular Formula: C8H3BrF6 Molecular Weight (g/mol): 293.006 MDL Number: MFCD00000381 InChI Key: CSVCVIHEBDJTCJ-UHFFFAOYSA-N Synonym: 3,5-bis trifluoromethyl bromobenzene,1-bromo-3,5-bis trifluoromethyl benzene,1,3-bis trifluoromethyl-5-bromobenzene,mbt-br,3,5-di trifluoromethyl bromobenzene,3,5-bis trifluoromethyl-1-bromobenzene,3,5-bis-trifluoromethylbromobenzene,benzene, 1-bromo-3,5-bis trifluoromethyl,3,5-bis trifluoromethyl phenyl bromide,1-bromo-3,5-bis-trifluoromethyl-benzene PubChem CID: 67602 IUPAC Name: 1-bromo-3,5-bis(trifluoromethyl)benzene SMILES: C1=C(C=C(C=C1C(F)(F)F)Br)C(F)(F)F
| PubChem CID | 67602 |
|---|---|
| CAS | 328-70-1 |
| Molecular Weight (g/mol) | 293.006 |
| MDL Number | MFCD00000381 |
| SMILES | C1=C(C=C(C=C1C(F)(F)F)Br)C(F)(F)F |
| Synonym | 3,5-bis trifluoromethyl bromobenzene,1-bromo-3,5-bis trifluoromethyl benzene,1,3-bis trifluoromethyl-5-bromobenzene,mbt-br,3,5-di trifluoromethyl bromobenzene,3,5-bis trifluoromethyl-1-bromobenzene,3,5-bis-trifluoromethylbromobenzene,benzene, 1-bromo-3,5-bis trifluoromethyl,3,5-bis trifluoromethyl phenyl bromide,1-bromo-3,5-bis-trifluoromethyl-benzene |
| IUPAC Name | 1-bromo-3,5-bis(trifluoromethyl)benzene |
| InChI Key | CSVCVIHEBDJTCJ-UHFFFAOYSA-N |
| Molecular Formula | C8H3BrF6 |
N-Ethylbenzylamine 97.0+%, TCI America™
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CAS: 14321-27-8 Molecular Formula: C9H13N Molecular Weight (g/mol): 135.21 MDL Number: MFCD00009031 InChI Key: HVAAHUDGWQAAOJ-UHFFFAOYSA-N Synonym: n-ethylbenzylamine,benzenemethanamine, n-ethyl,ethylbenzylamine,n-benzylethylamine,benzyl ethyl amine,benzylamine, n-ethyl,benzylethylamine,unii-mm8324ke8v,n-benzyl-n-ethylamine,benzyl-ethyl-amine PubChem CID: 84352 IUPAC Name: N-benzylethanamine SMILES: CCNCC1=CC=CC=C1
| PubChem CID | 84352 |
|---|---|
| CAS | 14321-27-8 |
| Molecular Weight (g/mol) | 135.21 |
| MDL Number | MFCD00009031 |
| SMILES | CCNCC1=CC=CC=C1 |
| Synonym | n-ethylbenzylamine,benzenemethanamine, n-ethyl,ethylbenzylamine,n-benzylethylamine,benzyl ethyl amine,benzylamine, n-ethyl,benzylethylamine,unii-mm8324ke8v,n-benzyl-n-ethylamine,benzyl-ethyl-amine |
| IUPAC Name | N-benzylethanamine |
| InChI Key | HVAAHUDGWQAAOJ-UHFFFAOYSA-N |
| Molecular Formula | C9H13N |
9,9-Dimethylfluoren-2-boronic Acid (contains varying amounts of Anhydride), TCI America™
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| PubChem CID | 22348454 |
|---|---|
| CAS | 333432-28-3 |
| Molecular Weight (g/mol) | 238.093 |
| MDL Number | MFCD08704227 |
| Color | White-Yellow |
| Physical Form | Crystalline Powder |
| SMILES | B(C1=CC2=C(C=C1)C3=CC=CC=C3C2(C)C)(O)O |
| TSCA | No |
| IUPAC Name | (9,9-dimethylfluoren-2-yl)boronic acid |
| InChI Key | DMDPAJOXRYGXCB-UHFFFAOYSA-N |
| Molecular Formula | C15H15BO2 |
| Formula Weight | 238.09 |
7-Bromo-2-naphthol 97.0+%, TCI America™
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CAS: 116230-30-9 Molecular Formula: C10H7BrO Molecular Weight (g/mol): 223.069 MDL Number: MFCD00277644 InChI Key: VWSBGGRCEQOTNU-UHFFFAOYSA-N PubChem CID: 613827 IUPAC Name: 7-bromonaphthalen-2-ol SMILES: C1=CC(=CC2=C1C=CC(=C2)Br)O
| PubChem CID | 613827 |
|---|---|
| CAS | 116230-30-9 |
| Molecular Weight (g/mol) | 223.069 |
| MDL Number | MFCD00277644 |
| SMILES | C1=CC(=CC2=C1C=CC(=C2)Br)O |
| IUPAC Name | 7-bromonaphthalen-2-ol |
| InChI Key | VWSBGGRCEQOTNU-UHFFFAOYSA-N |
| Molecular Formula | C10H7BrO |
3,5-Bis(trifluoromethyl)benzyl Alcohol 98.0+%, TCI America™
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CAS: 32707-89-4 Molecular Formula: C9H6F6O Molecular Weight (g/mol): 244.136 MDL Number: MFCD00009907 InChI Key: BJTWPJOGDWRYDD-UHFFFAOYSA-N Synonym: 3,5-bis trifluoromethyl benzyl alcohol,3,5-bis trifluoromethyl phenyl methanol,3,5-bis-trifluoromethyl-phenyl-methanol,3,5-ditrifluoromethylbenzyl alcohol,benzenemethanol, 3,5-bis trifluoromethyl,3,5-bis trifluoromethyl benzylalcohol,3,5-di trifluoromethyl benzyl alcohol,3,5-di trifluoromethyl phenyl methanol,3,5-bis-trifluoromethyl benzyl alcohol PubChem CID: 122933 IUPAC Name: [3,5-bis(trifluoromethyl)phenyl]methanol SMILES: C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)CO
| PubChem CID | 122933 |
|---|---|
| CAS | 32707-89-4 |
| Molecular Weight (g/mol) | 244.136 |
| MDL Number | MFCD00009907 |
| SMILES | C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)CO |
| Synonym | 3,5-bis trifluoromethyl benzyl alcohol,3,5-bis trifluoromethyl phenyl methanol,3,5-bis-trifluoromethyl-phenyl-methanol,3,5-ditrifluoromethylbenzyl alcohol,benzenemethanol, 3,5-bis trifluoromethyl,3,5-bis trifluoromethyl benzylalcohol,3,5-di trifluoromethyl benzyl alcohol,3,5-di trifluoromethyl phenyl methanol,3,5-bis-trifluoromethyl benzyl alcohol |
| IUPAC Name | [3,5-bis(trifluoromethyl)phenyl]methanol |
| InChI Key | BJTWPJOGDWRYDD-UHFFFAOYSA-N |
| Molecular Formula | C9H6F6O |
N-Succinimidyl 3-Maleimidobenzoate 98.0+%, TCI America™
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CAS: 58626-38-3 Molecular Formula: C15H10N2O6 Molecular Weight (g/mol): 314.253 MDL Number: MFCD00005514 InChI Key: LLXVXPPXELIDGQ-UHFFFAOYSA-N Synonym: 3-maleimidobenzoic acid n-hydroxysuccinimide ester,n-succinimidyl 3-maleimidobenzoate,3-maleimidobenzoyl n-hydroxysuccinimide,1-3-2,5-dioxopyrrolidinyl oxy carbonyl phenyl-1h-pyrrole-2,5-dione,m-maleimidobenzoyl-n-hydroxysuccinimide ester,2,5-dioxopyrrolidin-1-yl 3-2,5-dioxopyrrol-1-yl benzoate,3-n-maleimidobenzoic acid n-succinimidyl ester,2,5-dioxopyrrolidin-1-yl 3-2,5-dioxo-2,5-dihydro-1h-pyrrol-1-yl benzoate,ambotzpeg2090 PubChem CID: 93861 IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 3-(2,5-dioxopyrrol-1-yl)benzoate SMILES: C1CC(=O)N(C1=O)OC(=O)C2=CC(=CC=C2)N3C(=O)C=CC3=O
| PubChem CID | 93861 |
|---|---|
| CAS | 58626-38-3 |
| Molecular Weight (g/mol) | 314.253 |
| MDL Number | MFCD00005514 |
| SMILES | C1CC(=O)N(C1=O)OC(=O)C2=CC(=CC=C2)N3C(=O)C=CC3=O |
| Synonym | 3-maleimidobenzoic acid n-hydroxysuccinimide ester,n-succinimidyl 3-maleimidobenzoate,3-maleimidobenzoyl n-hydroxysuccinimide,1-3-2,5-dioxopyrrolidinyl oxy carbonyl phenyl-1h-pyrrole-2,5-dione,m-maleimidobenzoyl-n-hydroxysuccinimide ester,2,5-dioxopyrrolidin-1-yl 3-2,5-dioxopyrrol-1-yl benzoate,3-n-maleimidobenzoic acid n-succinimidyl ester,2,5-dioxopyrrolidin-1-yl 3-2,5-dioxo-2,5-dihydro-1h-pyrrol-1-yl benzoate,ambotzpeg2090 |
| IUPAC Name | (2,5-dioxopyrrolidin-1-yl) 3-(2,5-dioxopyrrol-1-yl)benzoate |
| InChI Key | LLXVXPPXELIDGQ-UHFFFAOYSA-N |
| Molecular Formula | C15H10N2O6 |