Benzene and substituted derivatives
Filtered Search Results
4-Hydroxybenzotrifluoride 98.0+%, TCI America™
CAS: 402-45-9 Molecular Formula: C7H5F3O Molecular Weight (g/mol): 162.111 MDL Number: MFCD00002363 InChI Key: BAYGVMXZJBFEMB-UHFFFAOYSA-N Synonym: 4-trifluoromethyl phenol,4-hydroxybenzotrifluoride,alpha,alpha,alpha-trifluoro-p-cresol,p-trifluoromethylphenol,p-hydroxybenzotrifluoride,phenol, 4-trifluoromethyl,a,a,a-trifluoro-p-cresol,4-trifluoromethyl-phenol,para-trifluoromethylphenol PubChem CID: 67874 ChEBI: CHEBI:42578 IUPAC Name: 4-(trifluoromethyl)phenol SMILES: C1=CC(=CC=C1C(F)(F)F)O
| PubChem CID | 67874 |
|---|---|
| CAS | 402-45-9 |
| Molecular Weight (g/mol) | 162.111 |
| ChEBI | CHEBI:42578 |
| MDL Number | MFCD00002363 |
| SMILES | C1=CC(=CC=C1C(F)(F)F)O |
| Synonym | 4-trifluoromethyl phenol,4-hydroxybenzotrifluoride,alpha,alpha,alpha-trifluoro-p-cresol,p-trifluoromethylphenol,p-hydroxybenzotrifluoride,phenol, 4-trifluoromethyl,a,a,a-trifluoro-p-cresol,4-trifluoromethyl-phenol,para-trifluoromethylphenol |
| IUPAC Name | 4-(trifluoromethyl)phenol |
| InChI Key | BAYGVMXZJBFEMB-UHFFFAOYSA-N |
| Molecular Formula | C7H5F3O |
Benzethonium Chloride 97.0+%, TCI America™
CAS: 121-54-0 Molecular Formula: C27H42ClNO2 Molecular Weight (g/mol): 448.088 MDL Number: MFCD00011742 InChI Key: UREZNYTWGJKWBI-UHFFFAOYSA-M Synonym: benzethonium chloride,quatrachlor,hyamine,phemeride,phemerol chloride,benzethoniumchloride,phemithyn,disilyn,kylacol,solamin PubChem CID: 8478 ChEBI: CHEBI:31264 IUPAC Name: benzyl-dimethyl-[2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl]azanium;chloride SMILES: CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCCOCC[N+](C)(C)CC2=CC=CC=C2.[Cl-]
| PubChem CID | 8478 |
|---|---|
| CAS | 121-54-0 |
| Molecular Weight (g/mol) | 448.088 |
| ChEBI | CHEBI:31264 |
| MDL Number | MFCD00011742 |
| SMILES | CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCCOCC[N+](C)(C)CC2=CC=CC=C2.[Cl-] |
| Synonym | benzethonium chloride,quatrachlor,hyamine,phemeride,phemerol chloride,benzethoniumchloride,phemithyn,disilyn,kylacol,solamin |
| IUPAC Name | benzyl-dimethyl-[2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl]azanium;chloride |
| InChI Key | UREZNYTWGJKWBI-UHFFFAOYSA-M |
| Molecular Formula | C27H42ClNO2 |
Benzotrifluoride 98.0+%, TCI America™
CAS: 98-08-8 Molecular Formula: C7H5F3 Molecular Weight (g/mol): 146.112 MDL Number: MFCD00000372 InChI Key: GETTZEONDQJALK-UHFFFAOYSA-N Synonym: benzotrifluoride,trifluoromethyl benzene,alpha,alpha,alpha-trifluorotoluene,phenylfluoroform,benzene, trifluoromethyl,benzenyl fluoride,benzylidyne fluoride,usaf ma-16,a,a,a-trifluorotoluene,trifluoro toluene PubChem CID: 7368 ChEBI: CHEBI:36810 IUPAC Name: trifluoromethylbenzene SMILES: C1=CC=C(C=C1)C(F)(F)F
| PubChem CID | 7368 |
|---|---|
| CAS | 98-08-8 |
| Molecular Weight (g/mol) | 146.112 |
| ChEBI | CHEBI:36810 |
| MDL Number | MFCD00000372 |
| SMILES | C1=CC=C(C=C1)C(F)(F)F |
| Synonym | benzotrifluoride,trifluoromethyl benzene,alpha,alpha,alpha-trifluorotoluene,phenylfluoroform,benzene, trifluoromethyl,benzenyl fluoride,benzylidyne fluoride,usaf ma-16,a,a,a-trifluorotoluene,trifluoro toluene |
| IUPAC Name | trifluoromethylbenzene |
| InChI Key | GETTZEONDQJALK-UHFFFAOYSA-N |
| Molecular Formula | C7H5F3 |
4-Bromostyrene (stabilized with TBC) 95.0+%, TCI America™
CAS: 2039-82-9 Molecular Formula: C8H7Br Molecular Weight (g/mol): 183.05 MDL Number: MFCD00000110 InChI Key: WGGLDBIZIQMEGH-UHFFFAOYSA-N Synonym: 4-bromostyrene,1-bromo-4-vinylbenzene,p-bromostyrene,benzene, 1-bromo-4-ethenyl,styrene, p-bromo,1-4-bromophenyl ethylene,unii-tvk4s80xlu,p-bromo styrene,1-bromo-4-vinyl-benzene,tvk4s80xlu PubChem CID: 16263 IUPAC Name: 1-bromo-4-ethenylbenzene SMILES: BrC1=CC=C(C=C)C=C1
| PubChem CID | 16263 |
|---|---|
| CAS | 2039-82-9 |
| Molecular Weight (g/mol) | 183.05 |
| MDL Number | MFCD00000110 |
| SMILES | BrC1=CC=C(C=C)C=C1 |
| Synonym | 4-bromostyrene,1-bromo-4-vinylbenzene,p-bromostyrene,benzene, 1-bromo-4-ethenyl,styrene, p-bromo,1-4-bromophenyl ethylene,unii-tvk4s80xlu,p-bromo styrene,1-bromo-4-vinyl-benzene,tvk4s80xlu |
| IUPAC Name | 1-bromo-4-ethenylbenzene |
| InChI Key | WGGLDBIZIQMEGH-UHFFFAOYSA-N |
| Molecular Formula | C8H7Br |
4-tert-Butylstyrene (stabilized with TBC) 90.0+%, TCI America™
CAS: 1746-23-2 Molecular Formula: C12H16 Molecular Weight (g/mol): 160.26 MDL Number: MFCD00065126 InChI Key: QEDJMOONZLUIMC-UHFFFAOYSA-N Synonym: 4-tert-butylstyrene,p-tert-butylstyrene,p-t-butylstyrene,benzene, 1-1,1-dimethylethyl-4-ethenyl,styrene, p-tert-butyl,unii-9pct9cbw0v,1-1,1-dimethylethyl-4-ethenylbenzene,9pct9cbw0v,1-tert-butyl-4-vinylbenzene,4-t-butyl styrene PubChem CID: 15627 IUPAC Name: 1-tert-butyl-4-ethenylbenzene SMILES: CC(C)(C)C1=CC=C(C=C1)C=C
| PubChem CID | 15627 |
|---|---|
| CAS | 1746-23-2 |
| Molecular Weight (g/mol) | 160.26 |
| MDL Number | MFCD00065126 |
| SMILES | CC(C)(C)C1=CC=C(C=C1)C=C |
| Synonym | 4-tert-butylstyrene,p-tert-butylstyrene,p-t-butylstyrene,benzene, 1-1,1-dimethylethyl-4-ethenyl,styrene, p-tert-butyl,unii-9pct9cbw0v,1-1,1-dimethylethyl-4-ethenylbenzene,9pct9cbw0v,1-tert-butyl-4-vinylbenzene,4-t-butyl styrene |
| IUPAC Name | 1-tert-butyl-4-ethenylbenzene |
| InChI Key | QEDJMOONZLUIMC-UHFFFAOYSA-N |
| Molecular Formula | C12H16 |
2-Isopropenyltoluene (stabilized with BHT) 98.0+%, TCI America™
CAS: 7399-49-7 Molecular Formula: C10H12 Molecular Weight (g/mol): 132.206 MDL Number: MFCD00049092 InChI Key: OGMSGZZPTQNTIK-UHFFFAOYSA-N PubChem CID: 81886 IUPAC Name: 1-methyl-2-prop-1-en-2-ylbenzene SMILES: CC1=CC=CC=C1C(=C)C
| PubChem CID | 81886 |
|---|---|
| CAS | 7399-49-7 |
| Molecular Weight (g/mol) | 132.206 |
| MDL Number | MFCD00049092 |
| SMILES | CC1=CC=CC=C1C(=C)C |
| IUPAC Name | 1-methyl-2-prop-1-en-2-ylbenzene |
| InChI Key | OGMSGZZPTQNTIK-UHFFFAOYSA-N |
| Molecular Formula | C10H12 |
Cyhalofop Butyl 97.0+%, TCI America™
CAS: 122008-85-9 Molecular Formula: C20H20FNO4 Molecular Weight (g/mol): 357.381 MDL Number: MFCD01631151 InChI Key: TYIYMOAHACZAMQ-CQSZACIVSA-N Synonym: Butyl (R)-2-[4-(4-Cyano-2-fluorophenoxy)phenoxy]propionate, (R)-2-[4-(4-Cyano-2-fluorophenoxy)phenoxy]propionic Acid Butyl Ester PubChem CID: 180089 ChEBI: CHEBI:81863 IUPAC Name: butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate SMILES: CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F
| PubChem CID | 180089 |
|---|---|
| CAS | 122008-85-9 |
| Molecular Weight (g/mol) | 357.381 |
| ChEBI | CHEBI:81863 |
| MDL Number | MFCD01631151 |
| SMILES | CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F |
| Synonym | Butyl (R)-2-[4-(4-Cyano-2-fluorophenoxy)phenoxy]propionate, (R)-2-[4-(4-Cyano-2-fluorophenoxy)phenoxy]propionic Acid Butyl Ester |
| IUPAC Name | butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate |
| InChI Key | TYIYMOAHACZAMQ-CQSZACIVSA-N |
| Molecular Formula | C20H20FNO4 |
3-Nitrophthalic Acid 98.0+%, TCI America™
CAS: 603-11-2 Molecular Formula: C8H5NO6 Molecular Weight (g/mol): 211.129 MDL Number: MFCD00007138 InChI Key: KFIRODWJCYBBHY-UHFFFAOYSA-N Synonym: 3-nitrophthalic acid,3-nitrobenzene-1,2-dicarboxylic acid,phthalic acid, 3-nitro,1,2-benzenedicarboxylic acid, 3-nitro,3-nitro phthalic acid,3-nitro-phthalic acid,3-nitrophthalicacid,nitrophthalic acid,3-nitrophtalic acid,m-nitrophthalic acid PubChem CID: 69043 SMILES: C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)O)C(=O)O
| PubChem CID | 69043 |
|---|---|
| CAS | 603-11-2 |
| Molecular Weight (g/mol) | 211.129 |
| MDL Number | MFCD00007138 |
| SMILES | C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)O)C(=O)O |
| Synonym | 3-nitrophthalic acid,3-nitrobenzene-1,2-dicarboxylic acid,phthalic acid, 3-nitro,1,2-benzenedicarboxylic acid, 3-nitro,3-nitro phthalic acid,3-nitro-phthalic acid,3-nitrophthalicacid,nitrophthalic acid,3-nitrophtalic acid,m-nitrophthalic acid |
| InChI Key | KFIRODWJCYBBHY-UHFFFAOYSA-N |
| Molecular Formula | C8H5NO6 |
Methyl Salicylate 99.0+%, TCI America™
CAS: 119-36-8 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00002214 InChI Key: OSWPMRLSEDHDFF-UHFFFAOYSA-N Synonym: methyl salicylate,wintergreen oil,gaultheria oil,betula oil,teaberry oil,sweet birch oil,oil of wintergreen,analgit,spicewood oil,2-hydroxybenzoic acid methyl ester PubChem CID: 4133 ChEBI: CHEBI:31832 IUPAC Name: methyl 2-hydroxybenzoate SMILES: COC(=O)C1=CC=CC=C1O
| PubChem CID | 4133 |
|---|---|
| CAS | 119-36-8 |
| Molecular Weight (g/mol) | 152.149 |
| ChEBI | CHEBI:31832 |
| MDL Number | MFCD00002214 |
| SMILES | COC(=O)C1=CC=CC=C1O |
| Synonym | methyl salicylate,wintergreen oil,gaultheria oil,betula oil,teaberry oil,sweet birch oil,oil of wintergreen,analgit,spicewood oil,2-hydroxybenzoic acid methyl ester |
| IUPAC Name | methyl 2-hydroxybenzoate |
| InChI Key | OSWPMRLSEDHDFF-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
2-Nitroanisole 98.0+%, TCI America™
CAS: 91-23-6 Molecular Formula: C7H7NO3 Molecular Weight (g/mol): 153.14 MDL Number: MFCD00007096 InChI Key: CFBYEGUGFPZCNF-UHFFFAOYSA-N Synonym: 2-nitroanisole,o-nitroanisole,anisole, o-nitro,1-nitro-2-methoxybenzene,2-methoxynitrobenzene,o-nitrophenyl methyl ether,benzene, 1-methoxy-2-nitro,2-methoxy-1-nitrobenzene,benzene, methoxynitro,o-nitro methoxy benzene PubChem CID: 7048 ChEBI: CHEBI:48722 IUPAC Name: 1-methoxy-2-nitrobenzene SMILES: COC1=CC=CC=C1[N+]([O-])=O
| PubChem CID | 7048 |
|---|---|
| CAS | 91-23-6 |
| Molecular Weight (g/mol) | 153.14 |
| ChEBI | CHEBI:48722 |
| MDL Number | MFCD00007096 |
| SMILES | COC1=CC=CC=C1[N+]([O-])=O |
| Synonym | 2-nitroanisole,o-nitroanisole,anisole, o-nitro,1-nitro-2-methoxybenzene,2-methoxynitrobenzene,o-nitrophenyl methyl ether,benzene, 1-methoxy-2-nitro,2-methoxy-1-nitrobenzene,benzene, methoxynitro,o-nitro methoxy benzene |
| IUPAC Name | 1-methoxy-2-nitrobenzene |
| InChI Key | CFBYEGUGFPZCNF-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO3 |
4,4'-Dihydroxydiphenylmethane 99.0+%, TCI America™
CAS: 620-92-8 Molecular Formula: C13H12O2 Molecular Weight (g/mol): 200.237 MDL Number: MFCD00002385 InChI Key: PXKLMJQFEQBVLD-UHFFFAOYSA-N Synonym: 4,4'-methylenediphenol,bis 4-hydroxyphenyl methane,4,4'-dihydroxydiphenylmethane,phenol, 4,4'-methylenebis,p-p-hydroxybenzyl phenol,bis p-hydroxyphenyl methane,phenol, 4,4'-methylenedi,4,4'-methylenebisphenol,p,p'-bis hydroxyphenyl methane,4-4-hydroxyphenyl methyl phenol PubChem CID: 12111 ChEBI: CHEBI:34575 IUPAC Name: 4-[(4-hydroxyphenyl)methyl]phenol SMILES: C1=CC(=CC=C1CC2=CC=C(C=C2)O)O
| PubChem CID | 12111 |
|---|---|
| CAS | 620-92-8 |
| Molecular Weight (g/mol) | 200.237 |
| ChEBI | CHEBI:34575 |
| MDL Number | MFCD00002385 |
| SMILES | C1=CC(=CC=C1CC2=CC=C(C=C2)O)O |
| Synonym | 4,4'-methylenediphenol,bis 4-hydroxyphenyl methane,4,4'-dihydroxydiphenylmethane,phenol, 4,4'-methylenebis,p-p-hydroxybenzyl phenol,bis p-hydroxyphenyl methane,phenol, 4,4'-methylenedi,4,4'-methylenebisphenol,p,p'-bis hydroxyphenyl methane,4-4-hydroxyphenyl methyl phenol |
| IUPAC Name | 4-[(4-hydroxyphenyl)methyl]phenol |
| InChI Key | PXKLMJQFEQBVLD-UHFFFAOYSA-N |
| Molecular Formula | C13H12O2 |
2-Bromobenzophenone 97.0+%, TCI America™
CAS: 13047-06-8 Molecular Formula: C13H9BrO Molecular Weight (g/mol): 261.12 MDL Number: MFCD00032462 InChI Key: ABEVIHIQUUXDMS-UHFFFAOYSA-N PubChem CID: 2735534 IUPAC Name: (2-bromophenyl)(phenyl)methanone SMILES: BrC1=CC=CC=C1C(=O)C1=CC=CC=C1
| PubChem CID | 2735534 |
|---|---|
| CAS | 13047-06-8 |
| Molecular Weight (g/mol) | 261.12 |
| MDL Number | MFCD00032462 |
| SMILES | BrC1=CC=CC=C1C(=O)C1=CC=CC=C1 |
| IUPAC Name | (2-bromophenyl)(phenyl)methanone |
| InChI Key | ABEVIHIQUUXDMS-UHFFFAOYSA-N |
| Molecular Formula | C13H9BrO |
Ethyl (Triphenylphosphoranylidene)acetate 98.0+%, TCI America™
CAS: 1099-45-2 Molecular Formula: C22H21O2P Molecular Weight (g/mol): 348.38 MDL Number: MFCD00009183 InChI Key: IIHPVYJPDKJYOU-UHFFFAOYSA-N Synonym: carbethoxymethylene triphenylphosphorane,ethyl triphenylphosphoranylidene acetate,triphenylcarbethoxymethylenephosphorane,acetic acid, triphenylphosphoranylidene-, ethyl ester,ethyl 2-triphenylphosphoranylidene acetate,ethoxycarbonylmethylene triphenylphosphorane,carboethoxymethylidenetriphenylphosphorane,ethyl triphenylphosphoranilidene acetate,carbethoxytriphenylphosphonium methylide,carbethoxymethylidenetriphenylphosphorane PubChem CID: 70670 IUPAC Name: ethyl 2-(triphenyl-λ⁵-phosphanylidene)acetate SMILES: CCOC(=O)C=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 70670 |
|---|---|
| CAS | 1099-45-2 |
| Molecular Weight (g/mol) | 348.38 |
| MDL Number | MFCD00009183 |
| SMILES | CCOC(=O)C=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | carbethoxymethylene triphenylphosphorane,ethyl triphenylphosphoranylidene acetate,triphenylcarbethoxymethylenephosphorane,acetic acid, triphenylphosphoranylidene-, ethyl ester,ethyl 2-triphenylphosphoranylidene acetate,ethoxycarbonylmethylene triphenylphosphorane,carboethoxymethylidenetriphenylphosphorane,ethyl triphenylphosphoranilidene acetate,carbethoxytriphenylphosphonium methylide,carbethoxymethylidenetriphenylphosphorane |
| IUPAC Name | ethyl 2-(triphenyl-λ⁵-phosphanylidene)acetate |
| InChI Key | IIHPVYJPDKJYOU-UHFFFAOYSA-N |
| Molecular Formula | C22H21O2P |
Diamyl Phthalate 98.0+%, TCI America™
CAS: 131-18-0 Molecular Formula: C18H26O4 Molecular Weight (g/mol): 306.402 MDL Number: MFCD00041934 InChI Key: IPKKHRVROFYTEK-UHFFFAOYSA-N Synonym: dipentyl phthalate,di-n-pentyl phthalate,diamyl phthalate,amyl phthalate,amoil,di-n-amyl phthalate,di-n-pentylphthalate,phthalic acid, dipentyl ester,phthalic acid diamyl ester,1,2-benzenedicarboxylic acid, dipentyl ester PubChem CID: 8561 ChEBI: CHEBI:34680 IUPAC Name: dipentyl benzene-1,2-dicarboxylate SMILES: CCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCC
| PubChem CID | 8561 |
|---|---|
| CAS | 131-18-0 |
| Molecular Weight (g/mol) | 306.402 |
| ChEBI | CHEBI:34680 |
| MDL Number | MFCD00041934 |
| SMILES | CCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCC |
| Synonym | dipentyl phthalate,di-n-pentyl phthalate,diamyl phthalate,amyl phthalate,amoil,di-n-amyl phthalate,di-n-pentylphthalate,phthalic acid, dipentyl ester,phthalic acid diamyl ester,1,2-benzenedicarboxylic acid, dipentyl ester |
| IUPAC Name | dipentyl benzene-1,2-dicarboxylate |
| InChI Key | IPKKHRVROFYTEK-UHFFFAOYSA-N |
| Molecular Formula | C18H26O4 |