Benzenoids
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2,4-Dibromoaniline 98.0+%, TCI America™
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CAS: 615-57-6 Molecular Formula: C6H5Br2N Molecular Weight (g/mol): 250.921 MDL Number: MFCD00007633 InChI Key: DYSRXWYRUJCNFI-UHFFFAOYSA-N Synonym: benzenamine, 2,4-dibromo,2,4-dibromobenzenamine,2,4-dibromo-phenylamine,dibromobenzenamine,2,4-dibromanilin,pubchem3447,2,4-dibromophenylamine,benzenamine,4-dibromo,2,4-bis bromanyl aniline,acmc-209mu0 PubChem CID: 12004 IUPAC Name: 2,4-dibromoaniline SMILES: C1=CC(=C(C=C1Br)Br)N
| PubChem CID | 12004 |
|---|---|
| CAS | 615-57-6 |
| Molecular Weight (g/mol) | 250.921 |
| MDL Number | MFCD00007633 |
| SMILES | C1=CC(=C(C=C1Br)Br)N |
| Synonym | benzenamine, 2,4-dibromo,2,4-dibromobenzenamine,2,4-dibromo-phenylamine,dibromobenzenamine,2,4-dibromanilin,pubchem3447,2,4-dibromophenylamine,benzenamine,4-dibromo,2,4-bis bromanyl aniline,acmc-209mu0 |
| IUPAC Name | 2,4-dibromoaniline |
| InChI Key | DYSRXWYRUJCNFI-UHFFFAOYSA-N |
| Molecular Formula | C6H5Br2N |
2,4-Dibromoanisole 98.0+%, TCI America™
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CAS: 21702-84-1 Molecular Formula: C7H6Br2O Molecular Weight (g/mol): 265.932 MDL Number: MFCD00000079 InChI Key: XGXUGXPKRBQINS-UHFFFAOYSA-N PubChem CID: 27011 IUPAC Name: 2,4-dibromo-1-methoxybenzene SMILES: COC1=C(C=C(C=C1)Br)Br
| PubChem CID | 27011 |
|---|---|
| CAS | 21702-84-1 |
| Molecular Weight (g/mol) | 265.932 |
| MDL Number | MFCD00000079 |
| SMILES | COC1=C(C=C(C=C1)Br)Br |
| IUPAC Name | 2,4-dibromo-1-methoxybenzene |
| InChI Key | XGXUGXPKRBQINS-UHFFFAOYSA-N |
| Molecular Formula | C7H6Br2O |
2-(Trifluoromethyl)benzylamine 98.0+%, TCI America™
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CAS: 3048-01-9 Molecular Formula: C8H8F3N Molecular Weight (g/mol): 175.15 MDL Number: MFCD00010297 InChI Key: ZSKQIFWUTUZAGF-UHFFFAOYSA-N Synonym: 2-trifluoromethyl benzylamine,2-trifluoromethylbenzylamine,2-trifluoromethyl phenyl methanamine,o-trifluoromethylbenzyl amine,o-trifluoromethylbenzylamine,2-trifluoromethyl-benzylamine,1-2-trifluoromethyl phenyl methanamine,benzenemethanamine, 2-trifluoromethyl,o-trifluoromethyl benzylamine PubChem CID: 76447 IUPAC Name: [2-(trifluoromethyl)phenyl]methanamine SMILES: C1=CC=C(C(=C1)CN)C(F)(F)F
| PubChem CID | 76447 |
|---|---|
| CAS | 3048-01-9 |
| Molecular Weight (g/mol) | 175.15 |
| MDL Number | MFCD00010297 |
| SMILES | C1=CC=C(C(=C1)CN)C(F)(F)F |
| Synonym | 2-trifluoromethyl benzylamine,2-trifluoromethylbenzylamine,2-trifluoromethyl phenyl methanamine,o-trifluoromethylbenzyl amine,o-trifluoromethylbenzylamine,2-trifluoromethyl-benzylamine,1-2-trifluoromethyl phenyl methanamine,benzenemethanamine, 2-trifluoromethyl,o-trifluoromethyl benzylamine |
| IUPAC Name | [2-(trifluoromethyl)phenyl]methanamine |
| InChI Key | ZSKQIFWUTUZAGF-UHFFFAOYSA-N |
| Molecular Formula | C8H8F3N |
2-Bromo-4,5-dimethoxyphenol 97.0+%, TCI America™
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CAS: 129103-69-1 Molecular Formula: C8H9BrO3 Molecular Weight (g/mol): 233.06 MDL Number: MFCD11110624 InChI Key: YGMAGXHPUIGKFF-UHFFFAOYSA-N PubChem CID: 53217002 IUPAC Name: 2-bromo-4,5-dimethoxyphenol SMILES: COC1=CC(O)=C(Br)C=C1OC
| PubChem CID | 53217002 |
|---|---|
| CAS | 129103-69-1 |
| Molecular Weight (g/mol) | 233.06 |
| MDL Number | MFCD11110624 |
| SMILES | COC1=CC(O)=C(Br)C=C1OC |
| IUPAC Name | 2-bromo-4,5-dimethoxyphenol |
| InChI Key | YGMAGXHPUIGKFF-UHFFFAOYSA-N |
| Molecular Formula | C8H9BrO3 |
2,4,4'-Trihydroxybenzophenone 98.0+%, TCI America™
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CAS: 1470-79-7 Molecular Formula: C13H10O4 Molecular Weight (g/mol): 230.22 MDL Number: MFCD00002356 InChI Key: OKJFKPFBSPZTAH-UHFFFAOYSA-N Synonym: 2,4,4'-trihydroxybenzophenone,2,4-dihydroxyphenyl 4-hydroxyphenyl methanone,benzophenone, 2,4,4'-trihydroxy,unii-qp9121ig2s,methanone, 2,4-dihydroxyphenyl 4-hydroxyphenyl,2,4-dihydroxyphenyl p-hydroxybenzyl ketone,2,4-dihydroxyphenyl-4-hydroxyphenyl methanone,2,4-dihydroxy-phenyl-4-hydroxy-phenyl-methanone,dsstox_cid_24836,dsstox_rid_80517 PubChem CID: 73852 IUPAC Name: 4-(4-hydroxybenzoyl)benzene-1,3-diol SMILES: OC1=CC=C(C=C1)C(=O)C1=CC=C(O)C=C1O
| PubChem CID | 73852 |
|---|---|
| CAS | 1470-79-7 |
| Molecular Weight (g/mol) | 230.22 |
| MDL Number | MFCD00002356 |
| SMILES | OC1=CC=C(C=C1)C(=O)C1=CC=C(O)C=C1O |
| Synonym | 2,4,4'-trihydroxybenzophenone,2,4-dihydroxyphenyl 4-hydroxyphenyl methanone,benzophenone, 2,4,4'-trihydroxy,unii-qp9121ig2s,methanone, 2,4-dihydroxyphenyl 4-hydroxyphenyl,2,4-dihydroxyphenyl p-hydroxybenzyl ketone,2,4-dihydroxyphenyl-4-hydroxyphenyl methanone,2,4-dihydroxy-phenyl-4-hydroxy-phenyl-methanone,dsstox_cid_24836,dsstox_rid_80517 |
| IUPAC Name | 4-(4-hydroxybenzoyl)benzene-1,3-diol |
| InChI Key | OKJFKPFBSPZTAH-UHFFFAOYSA-N |
| Molecular Formula | C13H10O4 |
Tetramethylhydroquinone 95.0+%, TCI America™
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CAS: 527-18-4 Molecular Formula: C10H14O2 Molecular Weight (g/mol): 166.22 MDL Number: MFCD00045781 InChI Key: SUNVJLYYDZCIIK-UHFFFAOYSA-N Synonym: Dihydroxydurene, Durohydroquinone, 1,4-Dihydroxy-2,3,5,6-tetramethylbenzene, 2,3,5,6-Tetramethyl-1,4-benzenediol PubChem CID: 136346 IUPAC Name: 2,3,5,6-tetramethylbenzene-1,4-diol SMILES: CC1=C(C(=C(C(=C1O)C)C)O)C
| PubChem CID | 136346 |
|---|---|
| CAS | 527-18-4 |
| Molecular Weight (g/mol) | 166.22 |
| MDL Number | MFCD00045781 |
| SMILES | CC1=C(C(=C(C(=C1O)C)C)O)C |
| Synonym | Dihydroxydurene, Durohydroquinone, 1,4-Dihydroxy-2,3,5,6-tetramethylbenzene, 2,3,5,6-Tetramethyl-1,4-benzenediol |
| IUPAC Name | 2,3,5,6-tetramethylbenzene-1,4-diol |
| InChI Key | SUNVJLYYDZCIIK-UHFFFAOYSA-N |
| Molecular Formula | C10H14O2 |
3-Aminobenzyl Alcohol 98.0+%, TCI America™
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CAS: 1877-77-6 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.16 MDL Number: MFCD00007817 InChI Key: OJZQOQNSUZLSMV-UHFFFAOYSA-N Synonym: 3-aminobenzyl alcohol,3-aminophenyl methanol,m-aminobenzyl alcohol,3-aminobenzylalcohol,3-hydroxymethyl aniline,benzenemethanol, 3-amino,benzyl alcohol, m-amino,3-aminobenzenemethanol,unii-kn96abq0sp,m-aminophenylcarbinol PubChem CID: 80293 IUPAC Name: (3-aminophenyl)methanol SMILES: NC1=CC=CC(CO)=C1
| PubChem CID | 80293 |
|---|---|
| CAS | 1877-77-6 |
| Molecular Weight (g/mol) | 123.16 |
| MDL Number | MFCD00007817 |
| SMILES | NC1=CC=CC(CO)=C1 |
| Synonym | 3-aminobenzyl alcohol,3-aminophenyl methanol,m-aminobenzyl alcohol,3-aminobenzylalcohol,3-hydroxymethyl aniline,benzenemethanol, 3-amino,benzyl alcohol, m-amino,3-aminobenzenemethanol,unii-kn96abq0sp,m-aminophenylcarbinol |
| IUPAC Name | (3-aminophenyl)methanol |
| InChI Key | OJZQOQNSUZLSMV-UHFFFAOYSA-N |
| Molecular Formula | C7H9NO |
p-Tolylurea 98.0+%, TCI America™
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CAS: 622-51-5 Molecular Formula: C8H10N2O Molecular Weight (g/mol): 150.181 MDL Number: MFCD00025433 InChI Key: DMSHKWHLXNDUST-UHFFFAOYSA-N Synonym: p-tolylurea,p-tolylcarbamide,4-tolylurea,4-methylphenyl urea,urea, p-tolyl,1-p-tolyl urea,1-4-methylphenyl urea,p-tolycarbamide,urea, 4-methylphenyl,n-4-methylphenyl urea PubChem CID: 12148 IUPAC Name: (4-methylphenyl)urea SMILES: CC1=CC=C(C=C1)NC(=O)N
| PubChem CID | 12148 |
|---|---|
| CAS | 622-51-5 |
| Molecular Weight (g/mol) | 150.181 |
| MDL Number | MFCD00025433 |
| SMILES | CC1=CC=C(C=C1)NC(=O)N |
| Synonym | p-tolylurea,p-tolylcarbamide,4-tolylurea,4-methylphenyl urea,urea, p-tolyl,1-p-tolyl urea,1-4-methylphenyl urea,p-tolycarbamide,urea, 4-methylphenyl,n-4-methylphenyl urea |
| IUPAC Name | (4-methylphenyl)urea |
| InChI Key | DMSHKWHLXNDUST-UHFFFAOYSA-N |
| Molecular Formula | C8H10N2O |
3-Iodobenzyl Bromide 97.0+%, TCI America™
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CAS: 49617-83-6 Molecular Formula: C7H6BrI Molecular Weight (g/mol): 296.933 InChI Key: BACZSVQZBSCWIG-UHFFFAOYSA-N Synonym: 3-iodobenzyl bromide,1-bromomethyl-3-iodobenzene,alpha-bromo-3-iodotoluene,3-iodobenzylbromide,m-iodobenzyl bromide,benzene, 1-bromomethyl-3-iodo,m-iodobenzylbromide,3-iodo-benzylbromide,3-iodo-benzyl bromide,meta-iodobenzyl bromide PubChem CID: 2759361 IUPAC Name: 1-(bromomethyl)-3-iodobenzene SMILES: C1=CC(=CC(=C1)I)CBr
| PubChem CID | 2759361 |
|---|---|
| CAS | 49617-83-6 |
| Molecular Weight (g/mol) | 296.933 |
| SMILES | C1=CC(=CC(=C1)I)CBr |
| Synonym | 3-iodobenzyl bromide,1-bromomethyl-3-iodobenzene,alpha-bromo-3-iodotoluene,3-iodobenzylbromide,m-iodobenzyl bromide,benzene, 1-bromomethyl-3-iodo,m-iodobenzylbromide,3-iodo-benzylbromide,3-iodo-benzyl bromide,meta-iodobenzyl bromide |
| IUPAC Name | 1-(bromomethyl)-3-iodobenzene |
| InChI Key | BACZSVQZBSCWIG-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrI |
(S)-4-Isopropyl-3-(1-naphthylmethyl)-2,5,5-triphenyl-1,3,2-oxazaborolidine, TCI America™
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CAS: 850661-66-4 Molecular Formula: C34H32BNO Molecular Weight (g/mol): 481.446 InChI Key: KMDAQDQUTLTEPL-XIFFEERXSA-N PubChem CID: 12195798 IUPAC Name: (4S)-3-(naphthalen-1-ylmethyl)-2,5,5-triphenyl-4-propan-2-yl-1,3,2-oxazaborolidine SMILES: B1(N(C(C(O1)(C2=CC=CC=C2)C3=CC=CC=C3)C(C)C)CC4=CC=CC5=CC=CC=C54)C6=CC=CC=C6
| PubChem CID | 12195798 |
|---|---|
| CAS | 850661-66-4 |
| Molecular Weight (g/mol) | 481.446 |
| SMILES | B1(N(C(C(O1)(C2=CC=CC=C2)C3=CC=CC=C3)C(C)C)CC4=CC=CC5=CC=CC=C54)C6=CC=CC=C6 |
| IUPAC Name | (4S)-3-(naphthalen-1-ylmethyl)-2,5,5-triphenyl-4-propan-2-yl-1,3,2-oxazaborolidine |
| InChI Key | KMDAQDQUTLTEPL-XIFFEERXSA-N |
| Molecular Formula | C34H32BNO |
2,4-Bis(trifluoromethyl)phenylboronic Acid (contains varying amounts of Anhydride), TCI America™
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| PubChem CID | 2782667 |
|---|---|
| CAS | 153254-09-2 |
| MDL Number | MFCD01631349 |
| Color | White-Yellow |
| Physical Form | Crystalline Powder |
| TSCA | No |
| IUPAC Name | [2,4-bis(trifluoromethyl)phenyl]boronic acid |
| InChI Key | WLYPBMBWKYALCG-UHFFFAOYSA-N |
| Molecular Formula | C8H5BF6O2 |
| Formula Weight | 257.93 |
N-Methyl-p-toluidine 97.0+%, TCI America™
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CAS: 623-08-5 Molecular Formula: C8H11N Molecular Weight (g/mol): 121.18 MDL Number: MFCD00025628 InChI Key: QCIFLGSATTWUQJ-UHFFFAOYSA-N Synonym: N,4-Dimethylaniline, 4-(Methylamino)toluene PubChem CID: 12165 IUPAC Name: N,4-dimethylaniline SMILES: CNC1=CC=C(C)C=C1
| PubChem CID | 12165 |
|---|---|
| CAS | 623-08-5 |
| Molecular Weight (g/mol) | 121.18 |
| MDL Number | MFCD00025628 |
| SMILES | CNC1=CC=C(C)C=C1 |
| Synonym | N,4-Dimethylaniline, 4-(Methylamino)toluene |
| IUPAC Name | N,4-dimethylaniline |
| InChI Key | QCIFLGSATTWUQJ-UHFFFAOYSA-N |
| Molecular Formula | C8H11N |
2,6-Difluorobenzyl Chloride 98.0+%, TCI America™
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CAS: 697-73-4 Molecular Formula: C7H5ClF2 Molecular Weight (g/mol): 162.564 MDL Number: MFCD00191346 InChI Key: MJXRENZUAQXZGJ-UHFFFAOYSA-N PubChem CID: 581570 IUPAC Name: 2-(chloromethyl)-1,3-difluorobenzene SMILES: C1=CC(=C(C(=C1)F)CCl)F
| PubChem CID | 581570 |
|---|---|
| CAS | 697-73-4 |
| Molecular Weight (g/mol) | 162.564 |
| MDL Number | MFCD00191346 |
| SMILES | C1=CC(=C(C(=C1)F)CCl)F |
| IUPAC Name | 2-(chloromethyl)-1,3-difluorobenzene |
| InChI Key | MJXRENZUAQXZGJ-UHFFFAOYSA-N |
| Molecular Formula | C7H5ClF2 |
Trisodium Naphthalene-1,3,6-trisulfonate Hydrate 65.0+%, TCI America™
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CAS: 5182-30-9 Molecular Formula: C10H5Na3O9S3 Molecular Weight (g/mol): 434.29 MDL Number: MFCD00003989 InChI Key: NJPKYOIXTSGVAN-UHFFFAOYSA-K Synonym: trisodium 1,3,6-naphthalenetrisulfonate,1,3,6-naphthalenetrisulfonic acid, trisodium salt,naphthalene-1,3,6-trisulfonic acid trisodium salt,trisodium naphthalene-1,3,6-trisulfonate,sodium naphthalene-1,3,6-trisulfonate,trisodium 1,3,6-naphthalene trisulfonate,trisodium naphthalene-1,3,6-trisulphonate,1,3,6-naphthalenetrisulfonic acid, sodium salt 1:3,1,3,6-naphthalene trisulfonic acid trisodium salt,trisodium naphthalene trisulfonate PubChem CID: 78855 IUPAC Name: trisodium naphthalene-1,3,6-trisulfonate SMILES: [Na+].[Na+].[Na+].[O-]S(=O)(=O)C1=CC=C2C(=C1)C=C(C=C2S([O-])(=O)=O)S([O-])(=O)=O
| PubChem CID | 78855 |
|---|---|
| CAS | 5182-30-9 |
| Molecular Weight (g/mol) | 434.29 |
| MDL Number | MFCD00003989 |
| SMILES | [Na+].[Na+].[Na+].[O-]S(=O)(=O)C1=CC=C2C(=C1)C=C(C=C2S([O-])(=O)=O)S([O-])(=O)=O |
| Synonym | trisodium 1,3,6-naphthalenetrisulfonate,1,3,6-naphthalenetrisulfonic acid, trisodium salt,naphthalene-1,3,6-trisulfonic acid trisodium salt,trisodium naphthalene-1,3,6-trisulfonate,sodium naphthalene-1,3,6-trisulfonate,trisodium 1,3,6-naphthalene trisulfonate,trisodium naphthalene-1,3,6-trisulphonate,1,3,6-naphthalenetrisulfonic acid, sodium salt 1:3,1,3,6-naphthalene trisulfonic acid trisodium salt,trisodium naphthalene trisulfonate |
| IUPAC Name | trisodium naphthalene-1,3,6-trisulfonate |
| InChI Key | NJPKYOIXTSGVAN-UHFFFAOYSA-K |
| Molecular Formula | C10H5Na3O9S3 |
4-(Methylthio)phenylboronic Acid (contains varying amounts of Anhydride), TCI America™
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| PubChem CID | 2733959 |
|---|---|
| CAS | 98546-51-1 |
| Molecular Weight (g/mol) | 168.017 |
| MDL Number | MFCD00093410 |
| Color | White-Yellow |
| Physical Form | Crystalline Powder |
| SMILES | B(C1=CC=C(C=C1)SC)(O)O |
| TSCA | No |
| IUPAC Name | (4-methylsulfanylphenyl)boronic acid |
| InChI Key | IVUHTLFKBDDICS-UHFFFAOYSA-N |
| Molecular Formula | C7H9BO2S |
| Formula Weight | 168.02 |
| Melting Point | 213°C |