Benzene and substituted derivatives
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Dithizone, ACS Reagent Grade, Ricca Chemical
CAS: 60-10-6 Molecular Formula: C13H12N4S Molecular Weight (g/mol): 256.33 MDL Number: MFCD00003025 InChI Key: UOFGSWVZMUXXIY-UHFFFAOYSA-N Synonym: dithizone,dithizon,ditizon,carbazone, diphenylthio,usaf ek-3092,diazenecarbothioic acid, phenyl-, 2-phenylhydrazide,1,5-diphenyl-3-mercaptoformazan,3-formazanthiol, 1,5-diphenyl,unii-njz2cj4d6p,1,5-diphenyl-3-thiocarbazone PubChem CID: 657262 IUPAC Name: 3-(phenylamino)-1-(phenylimino)thiourea SMILES: S=C(NNC1=CC=CC=C1)N=NC1=CC=CC=C1
| PubChem CID | 657262 |
|---|---|
| CAS | 60-10-6 |
| Molecular Weight (g/mol) | 256.33 |
| MDL Number | MFCD00003025 |
| SMILES | S=C(NNC1=CC=CC=C1)N=NC1=CC=CC=C1 |
| Synonym | dithizone,dithizon,ditizon,carbazone, diphenylthio,usaf ek-3092,diazenecarbothioic acid, phenyl-, 2-phenylhydrazide,1,5-diphenyl-3-mercaptoformazan,3-formazanthiol, 1,5-diphenyl,unii-njz2cj4d6p,1,5-diphenyl-3-thiocarbazone |
| IUPAC Name | 3-(phenylamino)-1-(phenylimino)thiourea |
| InChI Key | UOFGSWVZMUXXIY-UHFFFAOYSA-N |
| Molecular Formula | C13H12N4S |
2-Naphthyl Benzoate 98.0+%, TCI America™
CAS: 93-44-7 Molecular Formula: C17H12O2 Molecular Weight (g/mol): 248.281 MDL Number: MFCD00014320 InChI Key: DWJIJRSTYFPKGD-UHFFFAOYSA-N Synonym: 2-naphthyl benzoate,benzonaphthol,2-naphthalenol, benzoate,betabenzon,2-benzoyloxynaphthalene,2-naphthylbenzoate,2-naphthol benzoate,beta-naphthol benzoate,beta-naphthyl benzoate,benzoic acid 2-naphthyl ester PubChem CID: 66734 IUPAC Name: naphthalen-2-yl benzoate SMILES: C1=CC=C(C=C1)C(=O)OC2=CC3=CC=CC=C3C=C2
| PubChem CID | 66734 |
|---|---|
| CAS | 93-44-7 |
| Molecular Weight (g/mol) | 248.281 |
| MDL Number | MFCD00014320 |
| SMILES | C1=CC=C(C=C1)C(=O)OC2=CC3=CC=CC=C3C=C2 |
| Synonym | 2-naphthyl benzoate,benzonaphthol,2-naphthalenol, benzoate,betabenzon,2-benzoyloxynaphthalene,2-naphthylbenzoate,2-naphthol benzoate,beta-naphthol benzoate,beta-naphthyl benzoate,benzoic acid 2-naphthyl ester |
| IUPAC Name | naphthalen-2-yl benzoate |
| InChI Key | DWJIJRSTYFPKGD-UHFFFAOYSA-N |
| Molecular Formula | C17H12O2 |
4-Fluoro-2-methoxybenzoic Acid 98.0+%, TCI America™
CAS: 395-82-4 Molecular Formula: C8H7FO3 Molecular Weight (g/mol): 170.14 MDL Number: MFCD00673010 InChI Key: UUQDNAPKWPKHMK-UHFFFAOYSA-N Synonym: 2-methoxy-4-fluorobenzoic acid,4-fluoro-2-methoxy-benzoic acid,4-fluoro-o-anisic acid,benzoic acid, 4-fluoro-2-methoxy,pubchem4969,acmc-209j6b,ksc494s1h,4-fluoro-2-methoxybenzoicacid,rarechem al be 1023,4-fluoro-2-methoxy benzoic acid PubChem CID: 2774545 IUPAC Name: 4-fluoro-2-methoxybenzoic acid SMILES: COC1=CC(F)=CC=C1C(O)=O
| PubChem CID | 2774545 |
|---|---|
| CAS | 395-82-4 |
| Molecular Weight (g/mol) | 170.14 |
| MDL Number | MFCD00673010 |
| SMILES | COC1=CC(F)=CC=C1C(O)=O |
| Synonym | 2-methoxy-4-fluorobenzoic acid,4-fluoro-2-methoxy-benzoic acid,4-fluoro-o-anisic acid,benzoic acid, 4-fluoro-2-methoxy,pubchem4969,acmc-209j6b,ksc494s1h,4-fluoro-2-methoxybenzoicacid,rarechem al be 1023,4-fluoro-2-methoxy benzoic acid |
| IUPAC Name | 4-fluoro-2-methoxybenzoic acid |
| InChI Key | UUQDNAPKWPKHMK-UHFFFAOYSA-N |
| Molecular Formula | C8H7FO3 |
N-Benzylethylenediamine 97.0+%, TCI America™
CAS: 9-4-4152 Molecular Formula: C9H14N2 Molecular Weight (g/mol): 150.23 MDL Number: MFCD00041896 InChI Key: ACYBVNYNIZTUIL-UHFFFAOYSA-N Synonym: n-benzylethylenediamine,n1-benzylethane-1,2-diamine,2-aminoethyl benzyl amine,ethylenediamine, n-benzyl,1,2-ethanediamine, n-phenylmethyl,n-2-aminoethyl-n-benzylamine,2-benzylaminoethylamine,n-benzylethane-1,2-diamine,1,2-ethanediamine, n1-phenylmethyl,2-aminoethyl benzylamine PubChem CID: 77801 IUPAC Name: N'-benzylethane-1,2-diamine SMILES: C1=CC=C(C=C1)CNCCN
| PubChem CID | 77801 |
|---|---|
| CAS | 9-4-4152 |
| Molecular Weight (g/mol) | 150.23 |
| MDL Number | MFCD00041896 |
| SMILES | C1=CC=C(C=C1)CNCCN |
| Synonym | n-benzylethylenediamine,n1-benzylethane-1,2-diamine,2-aminoethyl benzyl amine,ethylenediamine, n-benzyl,1,2-ethanediamine, n-phenylmethyl,n-2-aminoethyl-n-benzylamine,2-benzylaminoethylamine,n-benzylethane-1,2-diamine,1,2-ethanediamine, n1-phenylmethyl,2-aminoethyl benzylamine |
| IUPAC Name | N'-benzylethane-1,2-diamine |
| InChI Key | ACYBVNYNIZTUIL-UHFFFAOYSA-N |
| Molecular Formula | C9H14N2 |
Methyl m-Anisate 98.0+%, TCI America™
CAS: 5368-81-0 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00017193 InChI Key: DUKYPQBGYRJVAN-UHFFFAOYSA-N Synonym: methyl m-anisate,methyl m-methoxybenzoate,3-methoxybenzoic acid methyl ester,m-anisic acid, methyl ester,benzoic acid, 3-methoxy-, methyl ester,3-methoxybenoic acid methyl ester,m-methoxybenzoic acid methyl ester,mehtyl 3-methoxybenzoate,acmc-1asq5,m-anisic acid methyl ester PubChem CID: 79332 IUPAC Name: methyl 3-methoxybenzoate SMILES: COC(=O)C1=CC=CC(OC)=C1
| PubChem CID | 79332 |
|---|---|
| CAS | 5368-81-0 |
| Molecular Weight (g/mol) | 166.18 |
| MDL Number | MFCD00017193 |
| SMILES | COC(=O)C1=CC=CC(OC)=C1 |
| Synonym | methyl m-anisate,methyl m-methoxybenzoate,3-methoxybenzoic acid methyl ester,m-anisic acid, methyl ester,benzoic acid, 3-methoxy-, methyl ester,3-methoxybenoic acid methyl ester,m-methoxybenzoic acid methyl ester,mehtyl 3-methoxybenzoate,acmc-1asq5,m-anisic acid methyl ester |
| IUPAC Name | methyl 3-methoxybenzoate |
| InChI Key | DUKYPQBGYRJVAN-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
Triphenylphosphine Sulfide 99.0+%, TCI America™
CAS: 3878-45-3 Molecular Formula: C18H15PS Molecular Weight (g/mol): 294.35 MDL Number: MFCD00004917 InChI Key: VYNGFCUGSYEOOZ-UHFFFAOYSA-N Synonym: triphenylphosphine sulfide,phosphine sulfide, triphenyl,triphenylphosphine sulphide,triphenylphosphine monosulfide,triphenylphosphane sulfide,triphenylphosphino-1-thione,triphenylthioxophosphorane,triphenylphosphorus sulfide,wln: spr&r&r,triphenyl-,e5-phosphanethione PubChem CID: 19758 IUPAC Name: triphenyl-λ⁵-phosphanethione SMILES: S=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 19758 |
|---|---|
| CAS | 3878-45-3 |
| Molecular Weight (g/mol) | 294.35 |
| MDL Number | MFCD00004917 |
| SMILES | S=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | triphenylphosphine sulfide,phosphine sulfide, triphenyl,triphenylphosphine sulphide,triphenylphosphine monosulfide,triphenylphosphane sulfide,triphenylphosphino-1-thione,triphenylthioxophosphorane,triphenylphosphorus sulfide,wln: spr&r&r,triphenyl-,e5-phosphanethione |
| IUPAC Name | triphenyl-λ⁵-phosphanethione |
| InChI Key | VYNGFCUGSYEOOZ-UHFFFAOYSA-N |
| Molecular Formula | C18H15PS |
2-tert-Amylphenol 98.0+%, TCI America™
CAS: 3279-27-4 Molecular Formula: C11H16O Molecular Weight (g/mol): 164.248 InChI Key: BGRKGHSKCFAPCL-UHFFFAOYSA-N Synonym: 2-(1,1-Dimethylpropyl)phenol, 2-tert-Pentylphenol PubChem CID: 76769 IUPAC Name: 2-(2-methylbutan-2-yl)phenol SMILES: CCC(C)(C)C1=CC=CC=C1O
| PubChem CID | 76769 |
|---|---|
| CAS | 3279-27-4 |
| Molecular Weight (g/mol) | 164.248 |
| SMILES | CCC(C)(C)C1=CC=CC=C1O |
| Synonym | 2-(1,1-Dimethylpropyl)phenol, 2-tert-Pentylphenol |
| IUPAC Name | 2-(2-methylbutan-2-yl)phenol |
| InChI Key | BGRKGHSKCFAPCL-UHFFFAOYSA-N |
| Molecular Formula | C11H16O |
2-(Trifluoromethyl)benzyl Chloride 98.0+%, TCI America™
CAS: 21742-00-7 Molecular Formula: C8H6ClF3 Molecular Weight (g/mol): 194.581 MDL Number: MFCD00009920 InChI Key: BBXDMCQDLOCXRA-UHFFFAOYSA-N Synonym: 2-trifluoromethyl benzyl chloride,1-chloromethyl-2-trifluoromethyl benzene,2-trifluoromethyl benzylchloride,2-trifluoromethylbenzyl chloride,o-trifluoromethylbenzyl chloride,benzene, 1-chloromethyl-2-trifluoromethyl,alpha'-chloro-alpha,alpha,alpha-trifluoro-o-xylene,g1r bxfff,pubchem4692,acmc-209fnp PubChem CID: 89028 IUPAC Name: 1-(chloromethyl)-2-(trifluoromethyl)benzene SMILES: C1=CC=C(C(=C1)CCl)C(F)(F)F
| PubChem CID | 89028 |
|---|---|
| CAS | 21742-00-7 |
| Molecular Weight (g/mol) | 194.581 |
| MDL Number | MFCD00009920 |
| SMILES | C1=CC=C(C(=C1)CCl)C(F)(F)F |
| Synonym | 2-trifluoromethyl benzyl chloride,1-chloromethyl-2-trifluoromethyl benzene,2-trifluoromethyl benzylchloride,2-trifluoromethylbenzyl chloride,o-trifluoromethylbenzyl chloride,benzene, 1-chloromethyl-2-trifluoromethyl,alpha'-chloro-alpha,alpha,alpha-trifluoro-o-xylene,g1r bxfff,pubchem4692,acmc-209fnp |
| IUPAC Name | 1-(chloromethyl)-2-(trifluoromethyl)benzene |
| InChI Key | BBXDMCQDLOCXRA-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClF3 |
2-Methyl-5-nitrobenzoic Acid 98.0+%, TCI America™
CAS: 1975-52-6 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.147 MDL Number: MFCD00007371 InChI Key: DJRFJAVPROZZFL-UHFFFAOYSA-N Synonym: 2-methyl-5-nitrobenzoic acid,5-nitro-o-toluic acid,benzoic acid, 2-methyl-5-nitro,2-methyl-5-nitro-benzoic acid,5-nitro-2-methylbenzoic acid,rarechem al bo 0285,5-nitro-2-methyl benzoic acid,2-methyl-5-nitro benzoic acid,pubchem2244 PubChem CID: 519683 SMILES: CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O
| PubChem CID | 519683 |
|---|---|
| CAS | 1975-52-6 |
| Molecular Weight (g/mol) | 181.147 |
| MDL Number | MFCD00007371 |
| SMILES | CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O |
| Synonym | 2-methyl-5-nitrobenzoic acid,5-nitro-o-toluic acid,benzoic acid, 2-methyl-5-nitro,2-methyl-5-nitro-benzoic acid,5-nitro-2-methylbenzoic acid,rarechem al bo 0285,5-nitro-2-methyl benzoic acid,2-methyl-5-nitro benzoic acid,pubchem2244 |
| InChI Key | DJRFJAVPROZZFL-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO4 |
1,4-Bis(3-hydroxyphenoxy)benzene 96.0+%, TCI America™
CAS: 5085-95-0 Molecular Formula: C18H14O4 Molecular Weight (g/mol): 294.31 MDL Number: MFCD00142543 InChI Key: CHBWEVDVYGBMEJ-UHFFFAOYSA-N Synonym: Hydroquinone Bis(3-hydroxyphenyl) Ether PubChem CID: 626369 IUPAC Name: 3-[4-(3-hydroxyphenoxy)phenoxy]phenol SMILES: OC1=CC(OC2=CC=C(OC3=CC=CC(O)=C3)C=C2)=CC=C1
| PubChem CID | 626369 |
|---|---|
| CAS | 5085-95-0 |
| Molecular Weight (g/mol) | 294.31 |
| MDL Number | MFCD00142543 |
| SMILES | OC1=CC(OC2=CC=C(OC3=CC=CC(O)=C3)C=C2)=CC=C1 |
| Synonym | Hydroquinone Bis(3-hydroxyphenyl) Ether |
| IUPAC Name | 3-[4-(3-hydroxyphenoxy)phenoxy]phenol |
| InChI Key | CHBWEVDVYGBMEJ-UHFFFAOYSA-N |
| Molecular Formula | C18H14O4 |
2-Hydroxy-4-methoxybenzophenone-5-sulfonic Acid Hydrate (contains 5-10% Isopropyl Alcohol) 98.0+%, TCI America™
CAS: 4065-45-6 Molecular Formula: C14H12O6S Molecular Weight (g/mol): 308.30 MDL Number: MFCD00024962 InChI Key: CXVGEDCSTKKODG-UHFFFAOYSA-N Synonym: sulisobenzone,benzophenone-4,sungard,2-hydroxy-4-methoxybenzophenone-5-sulfonic acid,benzophenone 4,uval,uvinul,benzenesulfonic acid, 5-benzoyl-4-hydroxy-2-methoxy,sulisobenzona,sulisobenzonum PubChem CID: 19988 IUPAC Name: 5-benzoyl-4-hydroxy-2-methoxybenzene-1-sulfonic acid SMILES: COC1=CC(O)=C(C=C1S(O)(=O)=O)C(=O)C1=CC=CC=C1
| PubChem CID | 19988 |
|---|---|
| CAS | 4065-45-6 |
| Molecular Weight (g/mol) | 308.30 |
| MDL Number | MFCD00024962 |
| SMILES | COC1=CC(O)=C(C=C1S(O)(=O)=O)C(=O)C1=CC=CC=C1 |
| Synonym | sulisobenzone,benzophenone-4,sungard,2-hydroxy-4-methoxybenzophenone-5-sulfonic acid,benzophenone 4,uval,uvinul,benzenesulfonic acid, 5-benzoyl-4-hydroxy-2-methoxy,sulisobenzona,sulisobenzonum |
| IUPAC Name | 5-benzoyl-4-hydroxy-2-methoxybenzene-1-sulfonic acid |
| InChI Key | CXVGEDCSTKKODG-UHFFFAOYSA-N |
| Molecular Formula | C14H12O6S |
(1R,2S)-2-[N-Benzyl-N-(mesitylenesulfonyl)amino]-1-phenylpropyl Propionate 98.0+%, TCI America™
CAS: 187324-66-9 Molecular Formula: C28H33NO4S Molecular Weight (g/mol): 479.64 MDL Number: MFCD02093490 InChI Key: WNCDSLPLRUHTTL-UHFFFAOYNA-N Synonym: Propionic Acid (1R,2S)-2-[N-Benzyl-N-(mesitylenesulfonyl)amino]-1-phenylpropyl Ester, (1R,2S)-N-Benzyl-N-(mesitylenesulfonyl)-O-propionylnorephedrine PubChem CID: 11190801 IUPAC Name: 2-(N-benzyl2,4,6-trimethylbenzenesulfonamido)-1-phenylpropyl propanoate SMILES: CCC(=O)OC(C(C)N(CC1=CC=CC=C1)S(=O)(=O)C1=C(C)C=C(C)C=C1C)C1=CC=CC=C1
| PubChem CID | 11190801 |
|---|---|
| CAS | 187324-66-9 |
| Molecular Weight (g/mol) | 479.64 |
| MDL Number | MFCD02093490 |
| SMILES | CCC(=O)OC(C(C)N(CC1=CC=CC=C1)S(=O)(=O)C1=C(C)C=C(C)C=C1C)C1=CC=CC=C1 |
| Synonym | Propionic Acid (1R,2S)-2-[N-Benzyl-N-(mesitylenesulfonyl)amino]-1-phenylpropyl Ester, (1R,2S)-N-Benzyl-N-(mesitylenesulfonyl)-O-propionylnorephedrine |
| IUPAC Name | 2-(N-benzyl2,4,6-trimethylbenzenesulfonamido)-1-phenylpropyl propanoate |
| InChI Key | WNCDSLPLRUHTTL-UHFFFAOYNA-N |
| Molecular Formula | C28H33NO4S |
3,4,5-Trimethoxybenzaldehyde 98.0+%, TCI America™
CAS: 86-81-7 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.202 MDL Number: MFCD00003364 InChI Key: OPHQOIGEOHXOGX-UHFFFAOYSA-N PubChem CID: 6858 IUPAC Name: 3,4,5-trimethoxybenzaldehyde SMILES: COC1=CC(=CC(=C1OC)OC)C=O
| PubChem CID | 6858 |
|---|---|
| CAS | 86-81-7 |
| Molecular Weight (g/mol) | 196.202 |
| MDL Number | MFCD00003364 |
| SMILES | COC1=CC(=CC(=C1OC)OC)C=O |
| IUPAC Name | 3,4,5-trimethoxybenzaldehyde |
| InChI Key | OPHQOIGEOHXOGX-UHFFFAOYSA-N |
| Molecular Formula | C10H12O4 |
2,4-Difluorophenyl Isocyanate 98.0+%, TCI America™
CAS: 59025-55-7 Molecular Formula: C7H3F2NO Molecular Weight (g/mol): 155.10 MDL Number: MFCD00001997 InChI Key: HNENEALJPWJWJY-UHFFFAOYSA-N Synonym: 2,4-difluorophenyl isocyanate,2,4-difluorophenylisocyanate,benzene, 2,4-difluoro-1-isocyanato,isocyanic acid 2,4-difluorophenyl ester,2,4-difluoro-1-isocyanato-benzene,2,4-difluoroisocyanatobenzene,timtec-bb sbb006537,pubchem4453,2,4-diflurophenylisocyanate,acmc-1b06k PubChem CID: 593258 IUPAC Name: 2,4-difluoro-1-isocyanatobenzene SMILES: FC1=CC=C(N=C=O)C(F)=C1
| PubChem CID | 593258 |
|---|---|
| CAS | 59025-55-7 |
| Molecular Weight (g/mol) | 155.10 |
| MDL Number | MFCD00001997 |
| SMILES | FC1=CC=C(N=C=O)C(F)=C1 |
| Synonym | 2,4-difluorophenyl isocyanate,2,4-difluorophenylisocyanate,benzene, 2,4-difluoro-1-isocyanato,isocyanic acid 2,4-difluorophenyl ester,2,4-difluoro-1-isocyanato-benzene,2,4-difluoroisocyanatobenzene,timtec-bb sbb006537,pubchem4453,2,4-diflurophenylisocyanate,acmc-1b06k |
| IUPAC Name | 2,4-difluoro-1-isocyanatobenzene |
| InChI Key | HNENEALJPWJWJY-UHFFFAOYSA-N |
| Molecular Formula | C7H3F2NO |
| PubChem CID | 2734393 |
|---|---|
| CAS | 2156-04-9 |
| Molecular Weight (g/mol) | 147.97 |
| MDL Number | MFCD00239441 |
| Color | White |
| Physical Form | Crystalline Powder |
| Chemical Name or Material | 4-Vinylphenylboronic Acid (contains varying amounts of Anhydride) |
| TSCA | No |
| IUPAC Name | (4-ethenylphenyl)boronic acid |
| InChI Key | QWMJEUJXWVZSAG-UHFFFAOYSA-N |
| Molecular Formula | C8H9BO2 |
| Formula Weight | 147.97 |