Benzenoids
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2-(Trifluoromethyl)benzoyl Chloride 98.0+%, TCI America™
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CAS: 312-94-7 Molecular Formula: C8H4ClF3O Molecular Weight (g/mol): 208.56 MDL Number: MFCD00000667 InChI Key: MXIUWSYTQJLIKE-UHFFFAOYSA-N Synonym: 2-trifluoromethyl benzoyl chloride,o-trifluoromethylbenzoyl chloride,alpha,alpha,alpha-trifluoro-o-toluoyl chloride,2-trifluoromethyl benzoylchloride,unii-d01d0b64eq,otf-boc,2-trifluoromethyl-benzoyl chloride,o-trifluoromethyl benzoyl chloride PubChem CID: 67561 IUPAC Name: 2-(trifluoromethyl)benzoyl chloride SMILES: FC(F)(F)C1=CC=CC=C1C(Cl)=O
| PubChem CID | 67561 |
|---|---|
| CAS | 312-94-7 |
| Molecular Weight (g/mol) | 208.56 |
| MDL Number | MFCD00000667 |
| SMILES | FC(F)(F)C1=CC=CC=C1C(Cl)=O |
| Synonym | 2-trifluoromethyl benzoyl chloride,o-trifluoromethylbenzoyl chloride,alpha,alpha,alpha-trifluoro-o-toluoyl chloride,2-trifluoromethyl benzoylchloride,unii-d01d0b64eq,otf-boc,2-trifluoromethyl-benzoyl chloride,o-trifluoromethyl benzoyl chloride |
| IUPAC Name | 2-(trifluoromethyl)benzoyl chloride |
| InChI Key | MXIUWSYTQJLIKE-UHFFFAOYSA-N |
| Molecular Formula | C8H4ClF3O |
Bis[3,5-dibromo-4-(2-hydroxyethoxy)phenyl] Sulfone 96.0+%, TCI America™
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CAS: 53714-39-9 Molecular Formula: C16H14Br4O6S Molecular Weight (g/mol): 653.958 MDL Number: MFCD00152428 InChI Key: OFBQIWFJRDGFEK-UHFFFAOYSA-N Synonym: Bis[4-(2-hydroxyethoxy)-3,5-dibromophenyl] Sulfone PubChem CID: 104566 IUPAC Name: 2-[2,6-dibromo-4-[3,5-dibromo-4-(2-hydroxyethoxy)phenyl]sulfonylphenoxy]ethanol SMILES: C1=C(C=C(C(=C1Br)OCCO)Br)S(=O)(=O)C2=CC(=C(C(=C2)Br)OCCO)Br
| PubChem CID | 104566 |
|---|---|
| CAS | 53714-39-9 |
| Molecular Weight (g/mol) | 653.958 |
| MDL Number | MFCD00152428 |
| SMILES | C1=C(C=C(C(=C1Br)OCCO)Br)S(=O)(=O)C2=CC(=C(C(=C2)Br)OCCO)Br |
| Synonym | Bis[4-(2-hydroxyethoxy)-3,5-dibromophenyl] Sulfone |
| IUPAC Name | 2-[2,6-dibromo-4-[3,5-dibromo-4-(2-hydroxyethoxy)phenyl]sulfonylphenoxy]ethanol |
| InChI Key | OFBQIWFJRDGFEK-UHFFFAOYSA-N |
| Molecular Formula | C16H14Br4O6S |
2-Cyclohexyl-5-methylphenol 97.0+%, TCI America™
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CAS: 1596-13-0 Molecular Formula: C13H18O Molecular Weight (g/mol): 190.286 MDL Number: MFCD00142903 InChI Key: SRGATTGYDONWOU-UHFFFAOYSA-N Synonym: 4-Cyclohexyl-3-hydroxytoluene PubChem CID: 1538498 IUPAC Name: 2-cyclohexyl-5-methylphenol SMILES: CC1=CC(=C(C=C1)C2CCCCC2)O
| PubChem CID | 1538498 |
|---|---|
| CAS | 1596-13-0 |
| Molecular Weight (g/mol) | 190.286 |
| MDL Number | MFCD00142903 |
| SMILES | CC1=CC(=C(C=C1)C2CCCCC2)O |
| Synonym | 4-Cyclohexyl-3-hydroxytoluene |
| IUPAC Name | 2-cyclohexyl-5-methylphenol |
| InChI Key | SRGATTGYDONWOU-UHFFFAOYSA-N |
| Molecular Formula | C13H18O |
3,4-Dibromotoluene 98.0+%, TCI America™
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CAS: 60956-23-2 Molecular Formula: C7H6Br2 Molecular Weight (g/mol): 249.933 MDL Number: MFCD00079744 InChI Key: LDCPXNOCWDGYIU-UHFFFAOYSA-N Synonym: 3,4-dibromotoluene,benzene, 1,2-dibromo-4-methyl,3,4 dibromo toluene,benzene,1,2-dibromo-4-methyl,3,4-dibromtoluol,3,4 dibromotoluene,pubchem3930,acmc-1b64t,ksc493e6j PubChem CID: 34679 IUPAC Name: 1,2-dibromo-4-methylbenzene SMILES: CC1=CC(=C(C=C1)Br)Br
| PubChem CID | 34679 |
|---|---|
| CAS | 60956-23-2 |
| Molecular Weight (g/mol) | 249.933 |
| MDL Number | MFCD00079744 |
| SMILES | CC1=CC(=C(C=C1)Br)Br |
| Synonym | 3,4-dibromotoluene,benzene, 1,2-dibromo-4-methyl,3,4 dibromo toluene,benzene,1,2-dibromo-4-methyl,3,4-dibromtoluol,3,4 dibromotoluene,pubchem3930,acmc-1b64t,ksc493e6j |
| IUPAC Name | 1,2-dibromo-4-methylbenzene |
| InChI Key | LDCPXNOCWDGYIU-UHFFFAOYSA-N |
| Molecular Formula | C7H6Br2 |
4-(Trifluoromethoxy)benzonitrile 98.0+%, TCI America™
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CAS: 332-25-2 Molecular Formula: C8H4F3NO Molecular Weight (g/mol): 187.121 MDL Number: MFCD00039474 InChI Key: XWHIXOMWXCHJPP-UHFFFAOYSA-N Synonym: 4-trifluoromethoxy benzonitrile,benzonitrile, 4-trifluoromethoxy,p-trifluoromethoxybenzonitrile,p-cyanotrifluoromethoxybenzene,p-trifluoromethoxy benzonitrile,1-cyano-4-trifluoromethoxy benzene,ncr doxfff,4-trifluoromethoxy benzenecarbonitrile,pubchem4826,acmc-1coco PubChem CID: 67621 IUPAC Name: 4-(trifluoromethoxy)benzonitrile SMILES: C1=CC(=CC=C1C#N)OC(F)(F)F
| PubChem CID | 67621 |
|---|---|
| CAS | 332-25-2 |
| Molecular Weight (g/mol) | 187.121 |
| MDL Number | MFCD00039474 |
| SMILES | C1=CC(=CC=C1C#N)OC(F)(F)F |
| Synonym | 4-trifluoromethoxy benzonitrile,benzonitrile, 4-trifluoromethoxy,p-trifluoromethoxybenzonitrile,p-cyanotrifluoromethoxybenzene,p-trifluoromethoxy benzonitrile,1-cyano-4-trifluoromethoxy benzene,ncr doxfff,4-trifluoromethoxy benzenecarbonitrile,pubchem4826,acmc-1coco |
| IUPAC Name | 4-(trifluoromethoxy)benzonitrile |
| InChI Key | XWHIXOMWXCHJPP-UHFFFAOYSA-N |
| Molecular Formula | C8H4F3NO |
Dansyl Fluoride 98.0+%, TCI America™
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CAS: 34523-28-9 Molecular Formula: C12H12FNO2S Molecular Weight (g/mol): 253.291 MDL Number: MFCD00042702 InChI Key: JMHHECQPPFEVMU-UHFFFAOYSA-N Synonym: 5-Dimethylaminonaphthalene-1-sulfonyl Fluoride PubChem CID: 93175 IUPAC Name: 5-(dimethylamino)naphthalene-1-sulfonyl fluoride SMILES: CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)F
| PubChem CID | 93175 |
|---|---|
| CAS | 34523-28-9 |
| Molecular Weight (g/mol) | 253.291 |
| MDL Number | MFCD00042702 |
| SMILES | CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)F |
| Synonym | 5-Dimethylaminonaphthalene-1-sulfonyl Fluoride |
| IUPAC Name | 5-(dimethylamino)naphthalene-1-sulfonyl fluoride |
| InChI Key | JMHHECQPPFEVMU-UHFFFAOYSA-N |
| Molecular Formula | C12H12FNO2S |
4-(Dimethylamino)benzyl Alcohol 98.0+%, TCI America™
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CAS: 1703-46-4 Molecular Formula: C9H13NO Molecular Weight (g/mol): 151.21 MDL Number: MFCD03840449 InChI Key: WQBCAASPALGAKX-UHFFFAOYSA-N Synonym: 4-Hydroxymethyl-N,N-dimethylaniline PubChem CID: 137166 IUPAC Name: [4-(dimethylamino)phenyl]methanol SMILES: CN(C)C1=CC=C(CO)C=C1
| PubChem CID | 137166 |
|---|---|
| CAS | 1703-46-4 |
| Molecular Weight (g/mol) | 151.21 |
| MDL Number | MFCD03840449 |
| SMILES | CN(C)C1=CC=C(CO)C=C1 |
| Synonym | 4-Hydroxymethyl-N,N-dimethylaniline |
| IUPAC Name | [4-(dimethylamino)phenyl]methanol |
| InChI Key | WQBCAASPALGAKX-UHFFFAOYSA-N |
| Molecular Formula | C9H13NO |
Isopropyl Salicylate 99.0+%, TCI America™
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CAS: 607-85-2 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00035703 InChI Key: YEULQIJMIOWCHB-UHFFFAOYSA-N Synonym: isopropyl salicylate,isopropyl 2-hydroxybenzoate,salicylic acid, isopropyl ester,iso-propyl salicylate,salicylic acid isopropyl ester,isopropyl o-hydroxybenzoate,benzoic acid, 2-hydroxy-, 1-methylethyl ester,1-methylethyl 2-hydroxybenzoate,methylethyl 2-hydroxybenzoate,opropyl salicylate PubChem CID: 11838 ChEBI: CHEBI:38703 IUPAC Name: propan-2-yl 2-hydroxybenzoate SMILES: CC(C)OC(=O)C1=CC=CC=C1O
| PubChem CID | 11838 |
|---|---|
| CAS | 607-85-2 |
| Molecular Weight (g/mol) | 180.203 |
| ChEBI | CHEBI:38703 |
| MDL Number | MFCD00035703 |
| SMILES | CC(C)OC(=O)C1=CC=CC=C1O |
| Synonym | isopropyl salicylate,isopropyl 2-hydroxybenzoate,salicylic acid, isopropyl ester,iso-propyl salicylate,salicylic acid isopropyl ester,isopropyl o-hydroxybenzoate,benzoic acid, 2-hydroxy-, 1-methylethyl ester,1-methylethyl 2-hydroxybenzoate,methylethyl 2-hydroxybenzoate,opropyl salicylate |
| IUPAC Name | propan-2-yl 2-hydroxybenzoate |
| InChI Key | YEULQIJMIOWCHB-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
Bianthrone 95.0+%, TCI America™
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CAS: 434-85-5 Molecular Formula: C28H16O2 Molecular Weight (g/mol): 384.434 MDL Number: MFCD00001238 InChI Key: MGRRGKWPEVFJSH-UHFFFAOYSA-N Synonym: bianthrone,10h,10'h-9,9'-bianthracenylidene-10,10'-dione,dehydrodianthrone,9 10h-anthracenone, 10-10-oxo-9 10h-anthracenylidene,.delta.10,10'-bianthrone,10-10-oxo-9-anthrylidene anthracen-9-one,10-10-oxoanthracen-9-ylidene anthracen-9-one,bisanthrone,10-10-oxoanthracen-9 10h-ylidene anthracen-9 10h-one,9,9'-bianthracenylidene-10,10'-dione PubChem CID: 67948 IUPAC Name: 10-(10-oxoanthracen-9-ylidene)anthracen-9-one SMILES: C1=CC=C2C(=C1)C(=C3C4=CC=CC=C4C(=O)C5=CC=CC=C53)C6=CC=CC=C6C2=O
| PubChem CID | 67948 |
|---|---|
| CAS | 434-85-5 |
| Molecular Weight (g/mol) | 384.434 |
| MDL Number | MFCD00001238 |
| SMILES | C1=CC=C2C(=C1)C(=C3C4=CC=CC=C4C(=O)C5=CC=CC=C53)C6=CC=CC=C6C2=O |
| Synonym | bianthrone,10h,10'h-9,9'-bianthracenylidene-10,10'-dione,dehydrodianthrone,9 10h-anthracenone, 10-10-oxo-9 10h-anthracenylidene,.delta.10,10'-bianthrone,10-10-oxo-9-anthrylidene anthracen-9-one,10-10-oxoanthracen-9-ylidene anthracen-9-one,bisanthrone,10-10-oxoanthracen-9 10h-ylidene anthracen-9 10h-one,9,9'-bianthracenylidene-10,10'-dione |
| IUPAC Name | 10-(10-oxoanthracen-9-ylidene)anthracen-9-one |
| InChI Key | MGRRGKWPEVFJSH-UHFFFAOYSA-N |
| Molecular Formula | C28H16O2 |
2,7-Dibromo-9,9-bis[3-(dimethylamino)propyl]fluorene 98.0+%, TCI America™
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CAS: 673474-73-2 Molecular Formula: C23H30Br2N2 Molecular Weight (g/mol): 494.32 MDL Number: MFCD22988888 InChI Key: RJIWYGUYDXBQCJ-UHFFFAOYSA-N PubChem CID: 71721491 IUPAC Name: (3-{2,7-dibromo-9-[3-(dimethylamino)propyl]-9H-fluoren-9-yl}propyl)dimethylamine SMILES: CN(C)CCCC1(CCCN(C)C)C2=C(C=CC(Br)=C2)C2=C1C=C(Br)C=C2
| PubChem CID | 71721491 |
|---|---|
| CAS | 673474-73-2 |
| Molecular Weight (g/mol) | 494.32 |
| MDL Number | MFCD22988888 |
| SMILES | CN(C)CCCC1(CCCN(C)C)C2=C(C=CC(Br)=C2)C2=C1C=C(Br)C=C2 |
| IUPAC Name | (3-{2,7-dibromo-9-[3-(dimethylamino)propyl]-9H-fluoren-9-yl}propyl)dimethylamine |
| InChI Key | RJIWYGUYDXBQCJ-UHFFFAOYSA-N |
| Molecular Formula | C23H30Br2N2 |
3-(Trifluoromethyl)benzenesulfonamide 98.0+%, TCI America™
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CAS: 672-58-2 Molecular Formula: C7H6F3NO2S Molecular Weight (g/mol): 225.185 MDL Number: MFCD00042421 InChI Key: ZUTVRDMZQSHCID-UHFFFAOYSA-N Synonym: 3-trifluoromethyl benzenesulfonamide,3-trifluoromethyl benzene-1-sulfonamide,3-trifluoromethyl benzenesulphonamide,m-trifluoromethylbenzenesulfonamide,benzenesulfonamide, 3-trifluoromethyl,pubchem11763,maybridge3_000947,3-sulphamoylbenzotrifluoride,ksc493o8t,3-trifluoromethyl-benzenesulfonamide PubChem CID: 244076 IUPAC Name: 3-(trifluoromethyl)benzenesulfonamide SMILES: C1=CC(=CC(=C1)S(=O)(=O)N)C(F)(F)F
| PubChem CID | 244076 |
|---|---|
| CAS | 672-58-2 |
| Molecular Weight (g/mol) | 225.185 |
| MDL Number | MFCD00042421 |
| SMILES | C1=CC(=CC(=C1)S(=O)(=O)N)C(F)(F)F |
| Synonym | 3-trifluoromethyl benzenesulfonamide,3-trifluoromethyl benzene-1-sulfonamide,3-trifluoromethyl benzenesulphonamide,m-trifluoromethylbenzenesulfonamide,benzenesulfonamide, 3-trifluoromethyl,pubchem11763,maybridge3_000947,3-sulphamoylbenzotrifluoride,ksc493o8t,3-trifluoromethyl-benzenesulfonamide |
| IUPAC Name | 3-(trifluoromethyl)benzenesulfonamide |
| InChI Key | ZUTVRDMZQSHCID-UHFFFAOYSA-N |
| Molecular Formula | C7H6F3NO2S |
1,1,1-Tris(4-hydroxyphenyl)ethane 98.0+%, TCI America™
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CAS: 27955-94-8 Molecular Formula: C20H18O3 Molecular Weight (g/mol): 306.361 MDL Number: MFCD00012180 InChI Key: BRPSWMCDEYMRPE-UHFFFAOYSA-N PubChem CID: 93118 IUPAC Name: 4-[1,1-bis(4-hydroxyphenyl)ethyl]phenol SMILES: CC(C1=CC=C(C=C1)O)(C2=CC=C(C=C2)O)C3=CC=C(C=C3)O
| PubChem CID | 93118 |
|---|---|
| CAS | 27955-94-8 |
| Molecular Weight (g/mol) | 306.361 |
| MDL Number | MFCD00012180 |
| SMILES | CC(C1=CC=C(C=C1)O)(C2=CC=C(C=C2)O)C3=CC=C(C=C3)O |
| IUPAC Name | 4-[1,1-bis(4-hydroxyphenyl)ethyl]phenol |
| InChI Key | BRPSWMCDEYMRPE-UHFFFAOYSA-N |
| Molecular Formula | C20H18O3 |
1-Chloro-2-naphthol 98.0+%, TCI America™
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CAS: 633-99-8 Molecular Formula: C10H7ClO Molecular Weight (g/mol): 178.615 MDL Number: MFCD00997084 InChI Key: RMSOEGBYNWXXBG-UHFFFAOYSA-N PubChem CID: 12459 IUPAC Name: 1-chloronaphthalen-2-ol SMILES: C1=CC=C2C(=C1)C=CC(=C2Cl)O
| PubChem CID | 12459 |
|---|---|
| CAS | 633-99-8 |
| Molecular Weight (g/mol) | 178.615 |
| MDL Number | MFCD00997084 |
| SMILES | C1=CC=C2C(=C1)C=CC(=C2Cl)O |
| IUPAC Name | 1-chloronaphthalen-2-ol |
| InChI Key | RMSOEGBYNWXXBG-UHFFFAOYSA-N |
| Molecular Formula | C10H7ClO |
5-Amino-2,4-dichloroanisole 98.0+%, TCI America™
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CAS: 98446-49-2 Molecular Formula: C7H7Cl2NO Molecular Weight (g/mol): 192.039 MDL Number: MFCD00974410 InChI Key: AJROJTARXSATEB-UHFFFAOYSA-N Synonym: 5-amino-2,4-dichloroanisole,2,4-dichloro-5-methoxybenzenamine,4,6-dichloro-m-anisidine,2,4-dichloro-5-methoxy-phenylamine,benzenamine, 2,4-dichloro-5-methoxy,2,4-dichloro-5-methoxyphenylamine,dichloromethoxyaniline,pubchem4393,acmc-209sae,4,5-dichloro-m-anisidine PubChem CID: 1476636 IUPAC Name: 2,4-dichloro-5-methoxyaniline SMILES: COC1=C(C=C(C(=C1)N)Cl)Cl
| PubChem CID | 1476636 |
|---|---|
| CAS | 98446-49-2 |
| Molecular Weight (g/mol) | 192.039 |
| MDL Number | MFCD00974410 |
| SMILES | COC1=C(C=C(C(=C1)N)Cl)Cl |
| Synonym | 5-amino-2,4-dichloroanisole,2,4-dichloro-5-methoxybenzenamine,4,6-dichloro-m-anisidine,2,4-dichloro-5-methoxy-phenylamine,benzenamine, 2,4-dichloro-5-methoxy,2,4-dichloro-5-methoxyphenylamine,dichloromethoxyaniline,pubchem4393,acmc-209sae,4,5-dichloro-m-anisidine |
| IUPAC Name | 2,4-dichloro-5-methoxyaniline |
| InChI Key | AJROJTARXSATEB-UHFFFAOYSA-N |
| Molecular Formula | C7H7Cl2NO |
3-Fluoro-4-methoxybenzyl Chloride 98.0+%, TCI America™
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CAS: 351-52-0 Molecular Formula: C8H8ClFO Molecular Weight (g/mol): 174.60 MDL Number: MFCD04973773 InChI Key: DDAXEANMRGIVDY-UHFFFAOYSA-N Synonym: 3-fluoro-4-methoxybenzyl chloride,4-chloromethyl-2-fluoro-1-methoxybenzene,3-fluoro-4-methoxybenzylchloride,benzene,4-chloromethyl-2-fluoro-1-methoxy,benzene, 4-chloromethyl-2-fluoro-1-methoxy,4-chloromethyl-2-fluorophenyl methyl ether,4-chloromethyl-2-fluoro-1-methoxy-benzene,3-fluor-4-methoxy-benzylchlorid,4-chloromethyl-2-fluoroanisole,3-fluoro-4-methoxy benzyl chloride PubChem CID: 2060903 IUPAC Name: 4-(chloromethyl)-2-fluoro-1-methoxybenzene SMILES: COC1=CC=C(CCl)C=C1F
| PubChem CID | 2060903 |
|---|---|
| CAS | 351-52-0 |
| Molecular Weight (g/mol) | 174.60 |
| MDL Number | MFCD04973773 |
| SMILES | COC1=CC=C(CCl)C=C1F |
| Synonym | 3-fluoro-4-methoxybenzyl chloride,4-chloromethyl-2-fluoro-1-methoxybenzene,3-fluoro-4-methoxybenzylchloride,benzene,4-chloromethyl-2-fluoro-1-methoxy,benzene, 4-chloromethyl-2-fluoro-1-methoxy,4-chloromethyl-2-fluorophenyl methyl ether,4-chloromethyl-2-fluoro-1-methoxy-benzene,3-fluor-4-methoxy-benzylchlorid,4-chloromethyl-2-fluoroanisole,3-fluoro-4-methoxy benzyl chloride |
| IUPAC Name | 4-(chloromethyl)-2-fluoro-1-methoxybenzene |
| InChI Key | DDAXEANMRGIVDY-UHFFFAOYSA-N |
| Molecular Formula | C8H8ClFO |