Benzene and substituted derivatives
Filtered Search Results
4-Bromotoluene, 98%
CAS: 106-38-7 Molecular Formula: C7H7Br Molecular Weight (g/mol): 171.04 MDL Number: MFCD00000109 InChI Key: ZBTMRBYMKUEVEU-UHFFFAOYSA-N Synonym: 4-bromotoluene,p-bromotoluene,4-methylbromobenzene,p-tolyl bromide,benzene, 1-bromo-4-methyl,toluene, p-bromo,p-methylphenyl bromide,p-methylbromobenzene,1-methyl-4-bromobenzene,4-bromo-1-methylbenzene PubChem CID: 7805 IUPAC Name: 1-bromo-4-methylbenzene SMILES: CC1=CC=C(Br)C=C1
| PubChem CID | 7805 |
|---|---|
| CAS | 106-38-7 |
| Molecular Weight (g/mol) | 171.04 |
| MDL Number | MFCD00000109 |
| SMILES | CC1=CC=C(Br)C=C1 |
| Synonym | 4-bromotoluene,p-bromotoluene,4-methylbromobenzene,p-tolyl bromide,benzene, 1-bromo-4-methyl,toluene, p-bromo,p-methylphenyl bromide,p-methylbromobenzene,1-methyl-4-bromobenzene,4-bromo-1-methylbenzene |
| IUPAC Name | 1-bromo-4-methylbenzene |
| InChI Key | ZBTMRBYMKUEVEU-UHFFFAOYSA-N |
| Molecular Formula | C7H7Br |
2,4,6-Trimethoxybenzyl alcohol, 97%
CAS: 61040-78-6 Molecular Formula: C10H14O4 Molecular Weight (g/mol): 198.218 MDL Number: MFCD00060356 InChI Key: CFXXBVNHYJQNKS-UHFFFAOYSA-N PubChem CID: 602515 IUPAC Name: (2,4,6-trimethoxyphenyl)methanol SMILES: COC1=CC(=C(C(=C1)OC)CO)OC
| PubChem CID | 602515 |
|---|---|
| CAS | 61040-78-6 |
| Molecular Weight (g/mol) | 198.218 |
| MDL Number | MFCD00060356 |
| SMILES | COC1=CC(=C(C(=C1)OC)CO)OC |
| IUPAC Name | (2,4,6-trimethoxyphenyl)methanol |
| InChI Key | CFXXBVNHYJQNKS-UHFFFAOYSA-N |
| Molecular Formula | C10H14O4 |
Isophthalaldehyde, 99%
CAS: 626-19-7 Molecular Formula: C8H6O2 Molecular Weight (g/mol): 134.13 MDL Number: MFCD00003372 InChI Key: IZALUMVGBVKPJD-UHFFFAOYSA-N Synonym: isophthalaldehyde,m-phthalaldehyde,1,3-benzenedicarboxaldehyde,1,3-benzenedialdehyde,isophtaldehydes,isophthaldehyde,isophthaldialdehyde,isophtaldehydes french,isophthalic dicarboxaldehyde,unii-lu162b2n9x PubChem CID: 34777 IUPAC Name: benzene-1,3-dicarbaldehyde SMILES: C1=CC(=CC(=C1)C=O)C=O
| PubChem CID | 34777 |
|---|---|
| CAS | 626-19-7 |
| Molecular Weight (g/mol) | 134.13 |
| MDL Number | MFCD00003372 |
| SMILES | C1=CC(=CC(=C1)C=O)C=O |
| Synonym | isophthalaldehyde,m-phthalaldehyde,1,3-benzenedicarboxaldehyde,1,3-benzenedialdehyde,isophtaldehydes,isophthaldehyde,isophthaldialdehyde,isophtaldehydes french,isophthalic dicarboxaldehyde,unii-lu162b2n9x |
| IUPAC Name | benzene-1,3-dicarbaldehyde |
| InChI Key | IZALUMVGBVKPJD-UHFFFAOYSA-N |
| Molecular Formula | C8H6O2 |
Allyltriphenylphosphonium bromide, 99%
CAS: 1560-54-9 Molecular Formula: C21H20BrP Molecular Weight (g/mol): 383.27 MDL Number: MFCD00011808 InChI Key: FWYKRJUVEOBFGH-UHFFFAOYSA-M Synonym: allyltriphenylphosphonium bromide,triphenyl allylphosphonium bromide,phosphonium, triphenyl-2-propenyl-, bromide,allyl triphenylphosphonium bromide,phosphonium, allyltriphenyl-, bromide,allyltriphenylphosphonium bromide tal,triphenyl prop-2-enyl phosphanium bromide,2-propenyltriphenylphosphonium bromide,triphenyl prop-2-en-1-yl phosphanium bromide,wln: 1u2pr&r&r &e PubChem CID: 197740 IUPAC Name: triphenyl(prop-2-enyl)phosphanium;bromide SMILES: [Br-].C=CC[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 197740 |
|---|---|
| CAS | 1560-54-9 |
| Molecular Weight (g/mol) | 383.27 |
| MDL Number | MFCD00011808 |
| SMILES | [Br-].C=CC[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | allyltriphenylphosphonium bromide,triphenyl allylphosphonium bromide,phosphonium, triphenyl-2-propenyl-, bromide,allyl triphenylphosphonium bromide,phosphonium, allyltriphenyl-, bromide,allyltriphenylphosphonium bromide tal,triphenyl prop-2-enyl phosphanium bromide,2-propenyltriphenylphosphonium bromide,triphenyl prop-2-en-1-yl phosphanium bromide,wln: 1u2pr&r&r &e |
| IUPAC Name | triphenyl(prop-2-enyl)phosphanium;bromide |
| InChI Key | FWYKRJUVEOBFGH-UHFFFAOYSA-M |
| Molecular Formula | C21H20BrP |
2-Hydroxybenzhydrazide, 98+%
CAS: 936-02-7 Molecular Formula: C7H8N2O2 Molecular Weight (g/mol): 152.153 MDL Number: MFCD00007599 InChI Key: XSXYESVZDBAKKT-UHFFFAOYSA-N Synonym: salicylhydrazide,2-hydroxybenzhydrazide,salicyl hydrazide,salicyloyl hydrazide,salicylic acid hydrazide,salicylic hydrazide,salicyloylhydrazine,salicylohydrazide,o-hydroxybenzhydrazide,o-hydroxybenzoylhydrazide PubChem CID: 13637 IUPAC Name: 2-hydroxybenzohydrazide SMILES: C1=CC=C(C(=C1)C(=O)NN)O
| PubChem CID | 13637 |
|---|---|
| CAS | 936-02-7 |
| Molecular Weight (g/mol) | 152.153 |
| MDL Number | MFCD00007599 |
| SMILES | C1=CC=C(C(=C1)C(=O)NN)O |
| Synonym | salicylhydrazide,2-hydroxybenzhydrazide,salicyl hydrazide,salicyloyl hydrazide,salicylic acid hydrazide,salicylic hydrazide,salicyloylhydrazine,salicylohydrazide,o-hydroxybenzhydrazide,o-hydroxybenzoylhydrazide |
| IUPAC Name | 2-hydroxybenzohydrazide |
| InChI Key | XSXYESVZDBAKKT-UHFFFAOYSA-N |
| Molecular Formula | C7H8N2O2 |
4-Bromophenyl isothiocyanate, 97%
CAS: 1985-12-2 Molecular Formula: C7H4BrNS Molecular Weight (g/mol): 214.08 MDL Number: MFCD00004808 InChI Key: XQACWEBGSZBLRG-UHFFFAOYSA-N Synonym: 4-bromophenyl isothiocyanate,trichofytocid,p-bromophenyl isothiocyanate,4-bromophenylisothiocyanate,benzene, 1-bromo-4-isothiocyanato,bromobenzene-4-isothiocyanate,isothiocyanic acid, p-bromophenyl ester,acmc-1bqku,wln: scnr de,p-bromophenylisothiocyanate PubChem CID: 16133 IUPAC Name: 1-bromo-4-isothiocyanatobenzene SMILES: C1=CC(=CC=C1N=C=S)Br
| PubChem CID | 16133 |
|---|---|
| CAS | 1985-12-2 |
| Molecular Weight (g/mol) | 214.08 |
| MDL Number | MFCD00004808 |
| SMILES | C1=CC(=CC=C1N=C=S)Br |
| Synonym | 4-bromophenyl isothiocyanate,trichofytocid,p-bromophenyl isothiocyanate,4-bromophenylisothiocyanate,benzene, 1-bromo-4-isothiocyanato,bromobenzene-4-isothiocyanate,isothiocyanic acid, p-bromophenyl ester,acmc-1bqku,wln: scnr de,p-bromophenylisothiocyanate |
| IUPAC Name | 1-bromo-4-isothiocyanatobenzene |
| InChI Key | XQACWEBGSZBLRG-UHFFFAOYSA-N |
| Molecular Formula | C7H4BrNS |
2-Chlorobenzotrifluoride, 99%
CAS: 88-16-4 Molecular Formula: C7H4ClF3 Molecular Weight (g/mol): 180.554 MDL Number: MFCD00000561 InChI Key: DGRVQOKCSKDWIH-UHFFFAOYSA-N Synonym: 2-chlorobenzotrifluoride,1-chloro-2-trifluoromethyl benzene,o-chlorobenzotrifluoride,chlorobenzotrifluoride,benzene, 1-chloro-2-trifluoromethyl,2-chloro trifluoromethyl benzene,2-chloro-alpha,alpha,alpha-trifluorotoluene,2-chloro-benzotrifluoride,o-trifluoromethyl chlorobenzene,o-trifluoromethyl phenyl chloride PubChem CID: 6921 IUPAC Name: 1-chloro-2-(trifluoromethyl)benzene SMILES: C1=CC=C(C(=C1)C(F)(F)F)Cl
| PubChem CID | 6921 |
|---|---|
| CAS | 88-16-4 |
| Molecular Weight (g/mol) | 180.554 |
| MDL Number | MFCD00000561 |
| SMILES | C1=CC=C(C(=C1)C(F)(F)F)Cl |
| Synonym | 2-chlorobenzotrifluoride,1-chloro-2-trifluoromethyl benzene,o-chlorobenzotrifluoride,chlorobenzotrifluoride,benzene, 1-chloro-2-trifluoromethyl,2-chloro trifluoromethyl benzene,2-chloro-alpha,alpha,alpha-trifluorotoluene,2-chloro-benzotrifluoride,o-trifluoromethyl chlorobenzene,o-trifluoromethyl phenyl chloride |
| IUPAC Name | 1-chloro-2-(trifluoromethyl)benzene |
| InChI Key | DGRVQOKCSKDWIH-UHFFFAOYSA-N |
| Molecular Formula | C7H4ClF3 |
Benzyltri-n-butylammonium bromide, 99%
CAS: 25316-59-0 Molecular Formula: C19H34BrN Molecular Weight (g/mol): 356.392 MDL Number: MFCD00011848 InChI Key: UDYGXWPMSJPFDG-UHFFFAOYSA-M Synonym: benzyltributylammonium bromide,tributylbenzylammonium bromide,n-benzyl-n,n-dibutylbutan-1-aminium bromide,benzyl tributyl ammonium bromide,benzenemethanaminium, n,n,n-tributyl-, bromide,benzyltri-n-butylammonium bromide,benzyltributylazanium bromide,benzyl-tributyl-azanium,benzyltributylammoniumbromide,pubchem7801 PubChem CID: 2724282 IUPAC Name: benzyl(tributyl)azanium;bromide SMILES: CCCC[N+](CCCC)(CCCC)CC1=CC=CC=C1.[Br-]
| PubChem CID | 2724282 |
|---|---|
| CAS | 25316-59-0 |
| Molecular Weight (g/mol) | 356.392 |
| MDL Number | MFCD00011848 |
| SMILES | CCCC[N+](CCCC)(CCCC)CC1=CC=CC=C1.[Br-] |
| Synonym | benzyltributylammonium bromide,tributylbenzylammonium bromide,n-benzyl-n,n-dibutylbutan-1-aminium bromide,benzyl tributyl ammonium bromide,benzenemethanaminium, n,n,n-tributyl-, bromide,benzyltri-n-butylammonium bromide,benzyltributylazanium bromide,benzyl-tributyl-azanium,benzyltributylammoniumbromide,pubchem7801 |
| IUPAC Name | benzyl(tributyl)azanium;bromide |
| InChI Key | UDYGXWPMSJPFDG-UHFFFAOYSA-M |
| Molecular Formula | C19H34BrN |
N-Boc-4-bromoaniline, 97%
CAS: 131818-17-2 Molecular Formula: C11H14BrNO2 Molecular Weight (g/mol): 272.14 MDL Number: MFCD01006612 InChI Key: VLGPDTPSKUUHKR-UHFFFAOYSA-N Synonym: tert-butyl 4-bromophenyl carbamate,tert-butyl n-4-bromophenyl carbamate,tert-butyl 4-bromophenylcarbamate,n-boc-4-bromoaniline,n-tert-butoxycarbonyl-4-bromoaniline,metronidazolebenzoate,n-boc 4-bromoaniline,4-bromo-n-boc aniline,acmc-1c4z5,t-butyl 4-bromophenylcarbamate PubChem CID: 2773608 IUPAC Name: tert-butyl N-(4-bromophenyl)carbamate SMILES: CC(C)(C)OC(=O)NC1=CC=C(Br)C=C1
| PubChem CID | 2773608 |
|---|---|
| CAS | 131818-17-2 |
| Molecular Weight (g/mol) | 272.14 |
| MDL Number | MFCD01006612 |
| SMILES | CC(C)(C)OC(=O)NC1=CC=C(Br)C=C1 |
| Synonym | tert-butyl 4-bromophenyl carbamate,tert-butyl n-4-bromophenyl carbamate,tert-butyl 4-bromophenylcarbamate,n-boc-4-bromoaniline,n-tert-butoxycarbonyl-4-bromoaniline,metronidazolebenzoate,n-boc 4-bromoaniline,4-bromo-n-boc aniline,acmc-1c4z5,t-butyl 4-bromophenylcarbamate |
| IUPAC Name | tert-butyl N-(4-bromophenyl)carbamate |
| InChI Key | VLGPDTPSKUUHKR-UHFFFAOYSA-N |
| Molecular Formula | C11H14BrNO2 |
Methylparaben, NF, 98-102%, Spectrum™ Chemical
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CAS: 99-76-3 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 InChI Key: LXCFILQKKLGQFO-UHFFFAOYSA-N IUPAC Name: methyl 4-hydroxybenzoate SMILES: COC(=O)C1=CC=C(O)C=C1
| CAS | 99-76-3 |
|---|---|
| Molecular Weight (g/mol) | 152.15 |
| SMILES | COC(=O)C1=CC=C(O)C=C1 |
| IUPAC Name | methyl 4-hydroxybenzoate |
| InChI Key | LXCFILQKKLGQFO-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
4-(Trifluoromethyl)benzenesulfonamide, 97%
CAS: 830-43-3 Molecular Formula: C7H6F3NO2S Molecular Weight (g/mol): 225.185 MDL Number: MFCD00159251 InChI Key: TVHXQQJDMHKGGK-UHFFFAOYSA-N Synonym: 4-trifluoromethyl benzenesulfonamide,4-trifluoromethyl benzene-1-sulfonamide,benzenesulfonamide, p-trifluoromethyl,4-trifluoromethylbenzenesulphonamide,p-trifluoromethyl benzenesulfonamide,4-trifluoromethyl benzenesulphonamide,benzenesulfonamide, 4-trifluoromethyl,p-trifluoromethylbenzenesulfonamide,alpha,alpha,alpha-trifluoro-p-toluenesulphonamide,pubchem11767 PubChem CID: 70018 IUPAC Name: 4-(trifluoromethyl)benzenesulfonamide SMILES: C1=CC(=CC=C1C(F)(F)F)S(=O)(=O)N
| PubChem CID | 70018 |
|---|---|
| CAS | 830-43-3 |
| Molecular Weight (g/mol) | 225.185 |
| MDL Number | MFCD00159251 |
| SMILES | C1=CC(=CC=C1C(F)(F)F)S(=O)(=O)N |
| Synonym | 4-trifluoromethyl benzenesulfonamide,4-trifluoromethyl benzene-1-sulfonamide,benzenesulfonamide, p-trifluoromethyl,4-trifluoromethylbenzenesulphonamide,p-trifluoromethyl benzenesulfonamide,4-trifluoromethyl benzenesulphonamide,benzenesulfonamide, 4-trifluoromethyl,p-trifluoromethylbenzenesulfonamide,alpha,alpha,alpha-trifluoro-p-toluenesulphonamide,pubchem11767 |
| IUPAC Name | 4-(trifluoromethyl)benzenesulfonamide |
| InChI Key | TVHXQQJDMHKGGK-UHFFFAOYSA-N |
| Molecular Formula | C7H6F3NO2S |
1,2-Dibenzoylethylene, predominantly trans, 96%
CAS: 959-28-4 Molecular Formula: C16H12O2 Molecular Weight (g/mol): 236.27 MDL Number: MFCD00003083 InChI Key: WYCXGQSQHAXLPK-VAWYXSNFSA-N Synonym: trans-1,2-dibenzoylethylene,dibenzoylethylene,1,2-dibenzoylethylene,1,4-diphenyl-2-butene-1,4-dione,trans-1,4-diphenyl-2-butene-1,4-dione,1,2-dibenzoylethene,ethylene, 1,2-dibenzoyl,usaf nd-57,2-butene-1,4-dione, 1,4-diphenyl,trans-diphenacylidene PubChem CID: 735960 IUPAC Name: (E)-1,4-diphenylbut-2-ene-1,4-dione SMILES: C1=CC=C(C=C1)C(=O)C=CC(=O)C2=CC=CC=C2
| PubChem CID | 735960 |
|---|---|
| CAS | 959-28-4 |
| Molecular Weight (g/mol) | 236.27 |
| MDL Number | MFCD00003083 |
| SMILES | C1=CC=C(C=C1)C(=O)C=CC(=O)C2=CC=CC=C2 |
| Synonym | trans-1,2-dibenzoylethylene,dibenzoylethylene,1,2-dibenzoylethylene,1,4-diphenyl-2-butene-1,4-dione,trans-1,4-diphenyl-2-butene-1,4-dione,1,2-dibenzoylethene,ethylene, 1,2-dibenzoyl,usaf nd-57,2-butene-1,4-dione, 1,4-diphenyl,trans-diphenacylidene |
| IUPAC Name | (E)-1,4-diphenylbut-2-ene-1,4-dione |
| InChI Key | WYCXGQSQHAXLPK-VAWYXSNFSA-N |
| Molecular Formula | C16H12O2 |
2-Isopropylphenol, 97%
CAS: 88-69-7 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.19 MDL Number: MFCD00002224 InChI Key: CRBJBYGJVIBWIY-UHFFFAOYSA-N Synonym: 2-isopropylphenol,o-hydroxycumene,o-isopropylphenol,o-cumenol,1-hydroxy-2-isopropylbenzene,2-propan-2-yl phenol,2-1-methylethyl phenol,phenol, o-isopropyl,phenol, 2-1-methylethyl,isopropylphenol PubChem CID: 6943 ChEBI: CHEBI:38506 IUPAC Name: 2-propan-2-ylphenol SMILES: CC(C)C1=CC=CC=C1O
| PubChem CID | 6943 |
|---|---|
| CAS | 88-69-7 |
| Molecular Weight (g/mol) | 136.19 |
| ChEBI | CHEBI:38506 |
| MDL Number | MFCD00002224 |
| SMILES | CC(C)C1=CC=CC=C1O |
| Synonym | 2-isopropylphenol,o-hydroxycumene,o-isopropylphenol,o-cumenol,1-hydroxy-2-isopropylbenzene,2-propan-2-yl phenol,2-1-methylethyl phenol,phenol, o-isopropyl,phenol, 2-1-methylethyl,isopropylphenol |
| IUPAC Name | 2-propan-2-ylphenol |
| InChI Key | CRBJBYGJVIBWIY-UHFFFAOYSA-N |
| Molecular Formula | C9H12O |
5,5'-Methylenedisalicylic acid, 95%
CAS: 122-25-8 Molecular Formula: C15H12O6 Molecular Weight (g/mol): 288.26 MDL Number: MFCD00016506 InChI Key: JWQFKVGACKJIAV-UHFFFAOYSA-N Synonym: 5,5'-methylenedisalicylic acid,5,5'-methylenebis 2-hydroxybenzoic acid,methylenebis salicylic acid,5,5-methylenebis salicylic acid,unii-2kf4fvv76n,5,5-methylenedisalicylic acid,5-3-carboxy-4-hydroxybenzyl salicylic acid,3,3'-dicarboxy-4,4'-dihydroxydiphenylmethane,4,4'-dihydroxy-3,3'-dicarboxydiphenylmethane,2kf4fvv76n PubChem CID: 67145 IUPAC Name: 5-[(3-carboxy-4-hydroxyphenyl)methyl]-2-hydroxybenzoic acid SMILES: C1=CC(=C(C=C1CC2=CC(=C(C=C2)O)C(=O)O)C(=O)O)O
| PubChem CID | 67145 |
|---|---|
| CAS | 122-25-8 |
| Molecular Weight (g/mol) | 288.26 |
| MDL Number | MFCD00016506 |
| SMILES | C1=CC(=C(C=C1CC2=CC(=C(C=C2)O)C(=O)O)C(=O)O)O |
| Synonym | 5,5'-methylenedisalicylic acid,5,5'-methylenebis 2-hydroxybenzoic acid,methylenebis salicylic acid,5,5-methylenebis salicylic acid,unii-2kf4fvv76n,5,5-methylenedisalicylic acid,5-3-carboxy-4-hydroxybenzyl salicylic acid,3,3'-dicarboxy-4,4'-dihydroxydiphenylmethane,4,4'-dihydroxy-3,3'-dicarboxydiphenylmethane,2kf4fvv76n |
| IUPAC Name | 5-[(3-carboxy-4-hydroxyphenyl)methyl]-2-hydroxybenzoic acid |
| InChI Key | JWQFKVGACKJIAV-UHFFFAOYSA-N |
| Molecular Formula | C15H12O6 |
4-Chloro-2-fluoro-5-nitrotoluene, 98%
CAS: 18349-11-6 Molecular Formula: C7H5ClFNO2 Molecular Weight (g/mol): 189.57 MDL Number: MFCD00134231 InChI Key: SJDPAVRCQNFVDM-UHFFFAOYSA-N Synonym: 4-chloro-2-fluoro-5-nitrotoluene,1-chloro-5-fluoro-4-methyl-2-nitro-benzene,toluene, 4-chloro-2-fluoro-5-nitro,benzene,1-chloro-5-fluoro-4-methyl-2-nitro,benzene, 1-chloro-5-fluoro-4-methyl-2-nitro,acmc-1c7av,4-chloro-2-fluoro-5-nitro-toluene,buttpark 146\15-31,2-chloro-4-floro-5-methylnitrobenzene,2-chloro-4-fluoro-5-methylnitrobenzene PubChem CID: 87593 IUPAC Name: 1-chloro-5-fluoro-4-methyl-2-nitrobenzene SMILES: CC1=CC(=C(Cl)C=C1F)[N+]([O-])=O
| PubChem CID | 87593 |
|---|---|
| CAS | 18349-11-6 |
| Molecular Weight (g/mol) | 189.57 |
| MDL Number | MFCD00134231 |
| SMILES | CC1=CC(=C(Cl)C=C1F)[N+]([O-])=O |
| Synonym | 4-chloro-2-fluoro-5-nitrotoluene,1-chloro-5-fluoro-4-methyl-2-nitro-benzene,toluene, 4-chloro-2-fluoro-5-nitro,benzene,1-chloro-5-fluoro-4-methyl-2-nitro,benzene, 1-chloro-5-fluoro-4-methyl-2-nitro,acmc-1c7av,4-chloro-2-fluoro-5-nitro-toluene,buttpark 146\15-31,2-chloro-4-floro-5-methylnitrobenzene,2-chloro-4-fluoro-5-methylnitrobenzene |
| IUPAC Name | 1-chloro-5-fluoro-4-methyl-2-nitrobenzene |
| InChI Key | SJDPAVRCQNFVDM-UHFFFAOYSA-N |
| Molecular Formula | C7H5ClFNO2 |