Benzene and substituted derivatives
Filtered Search Results
4-Sulfo-2,3,5,6-tetrafluorobenzoic Acid 95.0+%, TCI America™
CAS: 125662-60-4 Molecular Formula: C7H2F4O5S Molecular Weight (g/mol): 274.142 InChI Key: JNESNWCWZVATQY-UHFFFAOYSA-N PubChem CID: 19807654 IUPAC Name: 2,3,5,6-tetrafluoro-4-sulfobenzoic acid SMILES: C1(=C(C(=C(C(=C1F)F)S(=O)(=O)O)F)F)C(=O)O
| PubChem CID | 19807654 |
|---|---|
| CAS | 125662-60-4 |
| Molecular Weight (g/mol) | 274.142 |
| SMILES | C1(=C(C(=C(C(=C1F)F)S(=O)(=O)O)F)F)C(=O)O |
| IUPAC Name | 2,3,5,6-tetrafluoro-4-sulfobenzoic acid |
| InChI Key | JNESNWCWZVATQY-UHFFFAOYSA-N |
| Molecular Formula | C7H2F4O5S |
Isoamyl Salicylate (contains 2-Methylbutyl Salicylate), TCI America™
CAS: 87-20-7 Molecular Formula: C12H16O3 Molecular Weight (g/mol): 208.257 MDL Number: MFCD00020037 InChI Key: PMGCQNGBLMMXEW-UHFFFAOYSA-N Synonym: Isopentyl Salicylate, Salicylic Acid Isoamyl Ester, Isopentyl 2-Hydroxybenzoate PubChem CID: 6874 IUPAC Name: 3-methylbutyl 2-hydroxybenzoate SMILES: CC(C)CCOC(=O)C1=CC=CC=C1O
| PubChem CID | 6874 |
|---|---|
| CAS | 87-20-7 |
| Molecular Weight (g/mol) | 208.257 |
| MDL Number | MFCD00020037 |
| SMILES | CC(C)CCOC(=O)C1=CC=CC=C1O |
| Synonym | Isopentyl Salicylate, Salicylic Acid Isoamyl Ester, Isopentyl 2-Hydroxybenzoate |
| IUPAC Name | 3-methylbutyl 2-hydroxybenzoate |
| InChI Key | PMGCQNGBLMMXEW-UHFFFAOYSA-N |
| Molecular Formula | C12H16O3 |
Benzyl Salicylate 99.0+%, TCI America™
CAS: 118-58-1 Molecular Formula: C14H12O3 Molecular Weight (g/mol): 228.247 MDL Number: MFCD00020034 InChI Key: ZCTQGTTXIYCGGC-UHFFFAOYSA-N Synonym: benzyl salicylate,benzyl o-hydroxybenzoate,salicylic acid, benzyl ester,benzoic acid, 2-hydroxy-, phenylmethyl ester,phenylmethyl 2-hydroxybenzoate,salicylic acid benzyl ester,salicyclic acid, benzyl ester,salicylsaeurebenzylester,unii-wao5mnk9tu,salicyclic acid benzyl ester PubChem CID: 8363 IUPAC Name: benzyl 2-hydroxybenzoate SMILES: C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2O
| PubChem CID | 8363 |
|---|---|
| CAS | 118-58-1 |
| Molecular Weight (g/mol) | 228.247 |
| MDL Number | MFCD00020034 |
| SMILES | C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2O |
| Synonym | benzyl salicylate,benzyl o-hydroxybenzoate,salicylic acid, benzyl ester,benzoic acid, 2-hydroxy-, phenylmethyl ester,phenylmethyl 2-hydroxybenzoate,salicylic acid benzyl ester,salicyclic acid, benzyl ester,salicylsaeurebenzylester,unii-wao5mnk9tu,salicyclic acid benzyl ester |
| IUPAC Name | benzyl 2-hydroxybenzoate |
| InChI Key | ZCTQGTTXIYCGGC-UHFFFAOYSA-N |
| Molecular Formula | C14H12O3 |
Isopropyl Salicylate 99.0+%, TCI America™
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 |
p-Tolyldiethanolamine 98.0+%, TCI America™
CAS: 3077-12-1 Molecular Formula: C11H17NO2 Molecular Weight (g/mol): 195.26 MDL Number: MFCD00020580 InChI Key: JUVSRZCUMWZBFK-UHFFFAOYSA-N PubChem CID: 76497 IUPAC Name: 2-[N-(2-hydroxyethyl)-4-methylanilino]ethanol SMILES: CC1=CC=C(C=C1)N(CCO)CCO
| PubChem CID | 76497 |
|---|---|
| CAS | 3077-12-1 |
| Molecular Weight (g/mol) | 195.26 |
| MDL Number | MFCD00020580 |
| SMILES | CC1=CC=C(C=C1)N(CCO)CCO |
| IUPAC Name | 2-[N-(2-hydroxyethyl)-4-methylanilino]ethanol |
| InChI Key | JUVSRZCUMWZBFK-UHFFFAOYSA-N |
| Molecular Formula | C11H17NO2 |
| PubChem CID | 2734364 |
|---|---|
| CAS | 149104-88-1 |
| MDL Number | MFCD01630820 |
| Color | White-Yellow |
| Physical Form | Crystalline Powder |
| TSCA | No |
| InChI Key | VDUKDQTYMWUSAC-UHFFFAOYSA-N |
| Molecular Formula | C7H9BO4S |
| Formula Weight | 200.02 |
| Melting Point | 293°C |
Methyl 4-Hydroxybenzoate 99.0+%, TCI America™
CAS: 99-76-3 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00002352 InChI Key: LXCFILQKKLGQFO-UHFFFAOYSA-N Synonym: methylparaben,methyl paraben,methyl p-hydroxybenzoate,nipagin,methyl parahydroxybenzoate,maseptol,p-hydroxybenzoic acid methyl ester,4-hydroxybenzoic acid methyl ester,p-carbomethoxyphenol,tegosept m PubChem CID: 7456 ChEBI: CHEBI:31835 IUPAC Name: methyl 4-hydroxybenzoate SMILES: COC(=O)C1=CC=C(C=C1)O
| PubChem CID | 7456 |
|---|---|
| CAS | 99-76-3 |
| Molecular Weight (g/mol) | 152.149 |
| ChEBI | CHEBI:31835 |
| MDL Number | MFCD00002352 |
| SMILES | COC(=O)C1=CC=C(C=C1)O |
| Synonym | methylparaben,methyl paraben,methyl p-hydroxybenzoate,nipagin,methyl parahydroxybenzoate,maseptol,p-hydroxybenzoic acid methyl ester,4-hydroxybenzoic acid methyl ester,p-carbomethoxyphenol,tegosept m |
| IUPAC Name | methyl 4-hydroxybenzoate |
| InChI Key | LXCFILQKKLGQFO-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
Methyl 4-Chloro-3-methylbenzoate 98.0+%, TCI America™
CAS: 91367-05-4 Molecular Formula: C9H9ClO2 Molecular Weight (g/mol): 184.619 MDL Number: MFCD00151838 InChI Key: QOTGNXMPQNGYDM-UHFFFAOYSA-N Synonym: 4-chloro-3-methylbenzoic acid methyl ester,benzoic acid, 4-chloro-3-methyl-, methyl ester,pubchem3710,acmc-209r8w,2-chloro-5-methoxycarbonyl toluene,methyl 4-chloranyl-3-methyl-benzoate,4-chloro-m-toluic acid methyl ester,4-chloro-3-methylbenzoic acid, methyl ester PubChem CID: 7015786 IUPAC Name: methyl 4-chloro-3-methylbenzoate SMILES: CC1=C(C=CC(=C1)C(=O)OC)Cl
| PubChem CID | 7015786 |
|---|---|
| CAS | 91367-05-4 |
| Molecular Weight (g/mol) | 184.619 |
| MDL Number | MFCD00151838 |
| SMILES | CC1=C(C=CC(=C1)C(=O)OC)Cl |
| Synonym | 4-chloro-3-methylbenzoic acid methyl ester,benzoic acid, 4-chloro-3-methyl-, methyl ester,pubchem3710,acmc-209r8w,2-chloro-5-methoxycarbonyl toluene,methyl 4-chloranyl-3-methyl-benzoate,4-chloro-m-toluic acid methyl ester,4-chloro-3-methylbenzoic acid, methyl ester |
| IUPAC Name | methyl 4-chloro-3-methylbenzoate |
| InChI Key | QOTGNXMPQNGYDM-UHFFFAOYSA-N |
| Molecular Formula | C9H9ClO2 |
Methyl 5-Bromo-2-methyl-3-nitrobenzoate 98.0+%, TCI America™
CAS: 220514-28-3 Molecular Formula: C9H8BrNO4 Molecular Weight (g/mol): 274.07 MDL Number: MFCD07781280 InChI Key: UPBDNPCJIJAMPI-UHFFFAOYSA-N Synonym: 5-Bromo-2-methyl-3-nitrobenzoic Acid Methyl Ester PubChem CID: 24727998 IUPAC Name: methyl 5-bromo-2-methyl-3-nitrobenzoate SMILES: COC(=O)C1=CC(Br)=CC(=C1C)[N+]([O-])=O
| PubChem CID | 24727998 |
|---|---|
| CAS | 220514-28-3 |
| Molecular Weight (g/mol) | 274.07 |
| MDL Number | MFCD07781280 |
| SMILES | COC(=O)C1=CC(Br)=CC(=C1C)[N+]([O-])=O |
| Synonym | 5-Bromo-2-methyl-3-nitrobenzoic Acid Methyl Ester |
| IUPAC Name | methyl 5-bromo-2-methyl-3-nitrobenzoate |
| InChI Key | UPBDNPCJIJAMPI-UHFFFAOYSA-N |
| Molecular Formula | C9H8BrNO4 |
Methyl 4-Bromo-2-methoxybenzoate 98.0+%, TCI America™
CAS: 139102-34-4 Molecular Formula: C9H9BrO3 Molecular Weight (g/mol): 245.072 MDL Number: MFCD06797867 InChI Key: WPGAGRPPDYAZAD-UHFFFAOYSA-N Synonym: methyl4-bromo-2-methoxybenzoate,benzoic acid, 4-bromo-2-methoxy-, methyl ester,4-bromo-2-methoxybenzoic acid methyl ester,ablock ab-14-0789,benzoic acid,4-bromo-2-methoxy-, methyl ester,pubchem16069,acmc-209ciq,methyl-4-bromo-2-methoxybenzoate,zerenex e/1100188,4-bromo-2-methoxybenzoate 98 PubChem CID: 15128242 IUPAC Name: methyl 4-bromo-2-methoxybenzoate SMILES: COC1=C(C=CC(=C1)Br)C(=O)OC
| PubChem CID | 15128242 |
|---|---|
| CAS | 139102-34-4 |
| Molecular Weight (g/mol) | 245.072 |
| MDL Number | MFCD06797867 |
| SMILES | COC1=C(C=CC(=C1)Br)C(=O)OC |
| Synonym | methyl4-bromo-2-methoxybenzoate,benzoic acid, 4-bromo-2-methoxy-, methyl ester,4-bromo-2-methoxybenzoic acid methyl ester,ablock ab-14-0789,benzoic acid,4-bromo-2-methoxy-, methyl ester,pubchem16069,acmc-209ciq,methyl-4-bromo-2-methoxybenzoate,zerenex e/1100188,4-bromo-2-methoxybenzoate 98 |
| IUPAC Name | methyl 4-bromo-2-methoxybenzoate |
| InChI Key | WPGAGRPPDYAZAD-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO3 |
Methyl 5-Bromo-2-methylbenzoate 98.0+%, TCI America™
CAS: 79669-50-4 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD09839555 InChI Key: FDCYLMYCHALQJR-UHFFFAOYSA-N Synonym: methyl 5-bromo-2-methyl-benzoate,methyl 5-bromo-o-toluate,methyl5-bromo-2-methylbenzoate,5-bromo-2-methyl-benzoic acid methyl ester,benzoic acid, 5-bromo-2-methyl-, methyl ester,5-bromo-2-methylbenzoic acid methyl ester,5-bromo-2-methylbenzoicacid,methyl 4-bromo-toluate,pubchem10936,acmc-1bhme PubChem CID: 316201 IUPAC Name: methyl 5-bromo-2-methylbenzoate SMILES: CC1=C(C=C(C=C1)Br)C(=O)OC
| PubChem CID | 316201 |
|---|---|
| CAS | 79669-50-4 |
| Molecular Weight (g/mol) | 229.073 |
| MDL Number | MFCD09839555 |
| SMILES | CC1=C(C=C(C=C1)Br)C(=O)OC |
| Synonym | methyl 5-bromo-2-methyl-benzoate,methyl 5-bromo-o-toluate,methyl5-bromo-2-methylbenzoate,5-bromo-2-methyl-benzoic acid methyl ester,benzoic acid, 5-bromo-2-methyl-, methyl ester,5-bromo-2-methylbenzoic acid methyl ester,5-bromo-2-methylbenzoicacid,methyl 4-bromo-toluate,pubchem10936,acmc-1bhme |
| IUPAC Name | methyl 5-bromo-2-methylbenzoate |
| InChI Key | FDCYLMYCHALQJR-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
Methoxymethyl Phenyl Sulfone 98.0+%, TCI America™
CAS: 15251-78-2 Molecular Formula: C8H10O3S Molecular Weight (g/mol): 186.225 InChI Key: MZIVRTQIEKRAPI-UHFFFAOYSA-N PubChem CID: 366072 IUPAC Name: methoxymethylsulfonylbenzene SMILES: COCS(=O)(=O)C1=CC=CC=C1
| PubChem CID | 366072 |
|---|---|
| CAS | 15251-78-2 |
| Molecular Weight (g/mol) | 186.225 |
| SMILES | COCS(=O)(=O)C1=CC=CC=C1 |
| IUPAC Name | methoxymethylsulfonylbenzene |
| InChI Key | MZIVRTQIEKRAPI-UHFFFAOYSA-N |
| Molecular Formula | C8H10O3S |
4-Cyano-4'-propylbiphenyl 99.0+%, TCI America™
CAS: 58743-76-3 Molecular Formula: C16H15N Molecular Weight (g/mol): 221.30 MDL Number: MFCD00505987 InChI Key: XFMPTZWVMVMELB-UHFFFAOYSA-N Synonym: 4'-propyl-1,1'-biphenyl-4-carbonitrile,4-propyl-4'-cyanobiphenyl,4-cyano-4'-propylbiphenyl,1,1'-biphenyl-4-carbonitrile, 4'-propyl,4-cyano-4'-n-propylbiphenyl,4-4-propylphenyl benzonitrile,4-cyano-4'-n-propyl-biphenyl,4'-propyl-4-cyanobiphenyl,4'-propylbiphenyl-4-carbonitrile,4-trans-4-propylphenyl benzonitrile PubChem CID: 93891 IUPAC Name: 4'-propyl-[1,1'-biphenyl]-4-carbonitrile SMILES: CCCC1=CC=C(C=C1)C1=CC=C(C=C1)C#N
| PubChem CID | 93891 |
|---|---|
| CAS | 58743-76-3 |
| Molecular Weight (g/mol) | 221.30 |
| MDL Number | MFCD00505987 |
| SMILES | CCCC1=CC=C(C=C1)C1=CC=C(C=C1)C#N |
| Synonym | 4'-propyl-1,1'-biphenyl-4-carbonitrile,4-propyl-4'-cyanobiphenyl,4-cyano-4'-propylbiphenyl,1,1'-biphenyl-4-carbonitrile, 4'-propyl,4-cyano-4'-n-propylbiphenyl,4-4-propylphenyl benzonitrile,4-cyano-4'-n-propyl-biphenyl,4'-propyl-4-cyanobiphenyl,4'-propylbiphenyl-4-carbonitrile,4-trans-4-propylphenyl benzonitrile |
| IUPAC Name | 4'-propyl-[1,1'-biphenyl]-4-carbonitrile |
| InChI Key | XFMPTZWVMVMELB-UHFFFAOYSA-N |
| Molecular Formula | C16H15N |
4-Chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide 98.0+%, TCI America™
CAS: 41859-57-8 Molecular Formula: C15H14ClNO2 Molecular Weight (g/mol): 275.73 MDL Number: MFCD00218513 InChI Key: ZTLWJYCDAXUIBK-UHFFFAOYSA-N Synonym: n-4-chlorobenzoyl-tyramine,4-chloro-n-4-hydroxyphenethyl benzamide,4-chloro-n-2-4-hydroxyphenyl ethyl benzamide,n-4-chlorobenzoyl tyramine,benzamide, p-chloro-n-2-p-hydroxyphenyl ethyl,p-chloro-n-2-p-hydroxyphenyl ethyl benzamide,benzamide, 4-chloro-n-2-4-hydroxyphenyl ethyl,bez-da PubChem CID: 198234 IUPAC Name: 4-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide SMILES: OC1=CC=C(CCNC(=O)C2=CC=C(Cl)C=C2)C=C1
| PubChem CID | 198234 |
|---|---|
| CAS | 41859-57-8 |
| Molecular Weight (g/mol) | 275.73 |
| MDL Number | MFCD00218513 |
| SMILES | OC1=CC=C(CCNC(=O)C2=CC=C(Cl)C=C2)C=C1 |
| Synonym | n-4-chlorobenzoyl-tyramine,4-chloro-n-4-hydroxyphenethyl benzamide,4-chloro-n-2-4-hydroxyphenyl ethyl benzamide,n-4-chlorobenzoyl tyramine,benzamide, p-chloro-n-2-p-hydroxyphenyl ethyl,p-chloro-n-2-p-hydroxyphenyl ethyl benzamide,benzamide, 4-chloro-n-2-4-hydroxyphenyl ethyl,bez-da |
| IUPAC Name | 4-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide |
| InChI Key | ZTLWJYCDAXUIBK-UHFFFAOYSA-N |
| Molecular Formula | C15H14ClNO2 |