Benzene and substituted derivatives
Filtered Search Results
Diethyl phthalate, 99%
CAS: 84-66-2 Molecular Formula: C12H14O4 Molecular Weight (g/mol): 222.24 MDL Number: MFCD00009111 InChI Key: FLKPEMZONWLCSK-UHFFFAOYSA-N Synonym: diethyl phthalate,phthalic acid diethyl ester,ethyl phthalate,anozol,neantine,phthalol,solvanol,diethyl o-phthalate,palatinol a,placidol e PubChem CID: 6781 ChEBI: CHEBI:34698 IUPAC Name: diethyl benzene-1,2-dicarboxylate SMILES: CCOC(=O)C1=CC=CC=C1C(=O)OCC
| PubChem CID | 6781 |
|---|---|
| CAS | 84-66-2 |
| Molecular Weight (g/mol) | 222.24 |
| ChEBI | CHEBI:34698 |
| MDL Number | MFCD00009111 |
| SMILES | CCOC(=O)C1=CC=CC=C1C(=O)OCC |
| Synonym | diethyl phthalate,phthalic acid diethyl ester,ethyl phthalate,anozol,neantine,phthalol,solvanol,diethyl o-phthalate,palatinol a,placidol e |
| IUPAC Name | diethyl benzene-1,2-dicarboxylate |
| InChI Key | FLKPEMZONWLCSK-UHFFFAOYSA-N |
| Molecular Formula | C12H14O4 |
Styrene, 99%, stab. with 10-15ppm 4-tert-butylcatechol
CAS: 100-42-5 Molecular Formula: C8H8 Molecular Weight (g/mol): 104.15 MDL Number: MFCD00008612,MFCD00084450 InChI Key: PPBRXRYQALVLMV-UHFFFAOYSA-N Synonym: ethenylbenzene,phenylethylene,vinylbenzene,styrol,benzene, ethenyl,cinnamene,phenylethene,monomer,phenethylene,styrolene PubChem CID: 7501 ChEBI: CHEBI:27452 SMILES: C=CC1=CC=CC=C1
| PubChem CID | 7501 |
|---|---|
| CAS | 100-42-5 |
| Molecular Weight (g/mol) | 104.15 |
| ChEBI | CHEBI:27452 |
| MDL Number | MFCD00008612,MFCD00084450 |
| SMILES | C=CC1=CC=CC=C1 |
| Synonym | ethenylbenzene,phenylethylene,vinylbenzene,styrol,benzene, ethenyl,cinnamene,phenylethene,monomer,phenethylene,styrolene |
| InChI Key | PPBRXRYQALVLMV-UHFFFAOYSA-N |
| Molecular Formula | C8H8 |
4-Methoxybenzyl alcohol, 98%
CAS: 105-13-5 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.17 MDL Number: MFCD00004653 InChI Key: MSHFRERJPWKJFX-UHFFFAOYSA-N Synonym: 4-methoxybenzyl alcohol,4-methoxyphenyl methanol,anise alcohol,anisyl alcohol,p-anisyl alcohol,p-methoxybenzyl alcohol,benzenemethanol, 4-methoxy,anisic alcohol,p-anisol alcohol,4-methoxybenzenemethanol PubChem CID: 7738 ChEBI: CHEBI:86918 IUPAC Name: (4-methoxyphenyl)methanol SMILES: COC1=CC=C(CO)C=C1
| PubChem CID | 7738 |
|---|---|
| CAS | 105-13-5 |
| Molecular Weight (g/mol) | 138.17 |
| ChEBI | CHEBI:86918 |
| MDL Number | MFCD00004653 |
| SMILES | COC1=CC=C(CO)C=C1 |
| Synonym | 4-methoxybenzyl alcohol,4-methoxyphenyl methanol,anise alcohol,anisyl alcohol,p-anisyl alcohol,p-methoxybenzyl alcohol,benzenemethanol, 4-methoxy,anisic alcohol,p-anisol alcohol,4-methoxybenzenemethanol |
| IUPAC Name | (4-methoxyphenyl)methanol |
| InChI Key | MSHFRERJPWKJFX-UHFFFAOYSA-N |
| Molecular Formula | C8H10O2 |
Benzyl bromide, 98%
CAS: 100-39-0 MDL Number: MFCD00000172 InChI Key: AGEZXYOZHKGVCM-UHFFFAOYSA-N Synonym: benzyl bromide,bromomethyl benzene,alpha-bromotoluene,bromophenylmethane,benzene, bromomethyl,phenylmethyl bromide,1-bromotoluene,benzylbromide,cyclite PubChem CID: 7498 ChEBI: CHEBI:59858 IUPAC Name: bromomethylbenzene SMILES: C1=CC=C(C=C1)CBr
| PubChem CID | 7498 |
|---|---|
| CAS | 100-39-0 |
| ChEBI | CHEBI:59858 |
| MDL Number | MFCD00000172 |
| SMILES | C1=CC=C(C=C1)CBr |
| Synonym | benzyl bromide,bromomethyl benzene,alpha-bromotoluene,bromophenylmethane,benzene, bromomethyl,phenylmethyl bromide,1-bromotoluene,benzylbromide,cyclite |
| IUPAC Name | bromomethylbenzene |
| InChI Key | AGEZXYOZHKGVCM-UHFFFAOYSA-N |
Styrene-4-sulfonic acid sodium salt
CAS: 2695-37-6 Molecular Formula: C8H7NaO3S Molecular Weight (g/mol): 206.19 MDL Number: MFCD00013379 MFCD00084449 InChI Key: XFTALRAZSCGSKN-UHFFFAOYSA-M Synonym: sodium 4-vinylbenzenesulfonate,sodium p-styrenesulfonate,sodium 4-styrenesulfonate,sodium p-styrene sulfonate,unii-0kp0v3og5g,benzenesulfonic acid, 4-ethenyl-, sodium salt,poly sodium 4-vinylbenzenesulfonate,0kp0v3og5g,sodium 4-ethenylbenzenesulfonate,p-styrenesulfonic acid sodium salt PubChem CID: 3571582 IUPAC Name: sodium;4-ethenylbenzenesulfonate SMILES: [Na+].[O-]S(=O)(=O)C1=CC=C(C=C)C=C1
| PubChem CID | 3571582 |
|---|---|
| CAS | 2695-37-6 |
| Molecular Weight (g/mol) | 206.19 |
| MDL Number | MFCD00013379 MFCD00084449 |
| SMILES | [Na+].[O-]S(=O)(=O)C1=CC=C(C=C)C=C1 |
| Synonym | sodium 4-vinylbenzenesulfonate,sodium p-styrenesulfonate,sodium 4-styrenesulfonate,sodium p-styrene sulfonate,unii-0kp0v3og5g,benzenesulfonic acid, 4-ethenyl-, sodium salt,poly sodium 4-vinylbenzenesulfonate,0kp0v3og5g,sodium 4-ethenylbenzenesulfonate,p-styrenesulfonic acid sodium salt |
| IUPAC Name | sodium;4-ethenylbenzenesulfonate |
| InChI Key | XFTALRAZSCGSKN-UHFFFAOYSA-M |
| Molecular Formula | C8H7NaO3S |
3-Fluoroaniline, 98+%
CAS: 372-19-0 Molecular Formula: C6H6FN Molecular Weight (g/mol): 111.119 MDL Number: MFCD00007758 InChI Key: QZVQQUVWFIZUBQ-UHFFFAOYSA-N Synonym: m-fluoroaniline,1-amino-3-fluorobenzene,3-fluoranilin,benzenamine, 3-fluoro,3-fluorobenzenamine,3-fluoro-phenylamine,aniline, 3-fluoro,3-fluorophenylamine,aniline, m-fluoro,3-fluoranilin czech PubChem CID: 9742 ChEBI: CHEBI:27873 IUPAC Name: 3-fluoroaniline SMILES: C1=CC(=CC(=C1)F)N
| PubChem CID | 9742 |
|---|---|
| CAS | 372-19-0 |
| Molecular Weight (g/mol) | 111.119 |
| ChEBI | CHEBI:27873 |
| MDL Number | MFCD00007758 |
| SMILES | C1=CC(=CC(=C1)F)N |
| Synonym | m-fluoroaniline,1-amino-3-fluorobenzene,3-fluoranilin,benzenamine, 3-fluoro,3-fluorobenzenamine,3-fluoro-phenylamine,aniline, 3-fluoro,3-fluorophenylamine,aniline, m-fluoro,3-fluoranilin czech |
| IUPAC Name | 3-fluoroaniline |
| InChI Key | QZVQQUVWFIZUBQ-UHFFFAOYSA-N |
| Molecular Formula | C6H6FN |
Phthaldialdehyde, 98%
CAS: 643-79-8 Molecular Formula: C8H6O2 Molecular Weight (g/mol): 134.13 MDL Number: MFCD00003335 InChI Key: ZWLUXSQADUDCSB-UHFFFAOYSA-N Synonym: o-phthalaldehyde,o-phthaldialdehyde,benzene-1,2-dicarboxaldehyde,1,2-benzenedicarboxaldehyde,phthaldialdehyde,phthalic aldehyde,phthalic dialdehyde,phthalyldicarboxaldehyde,ortho-phthalaldehyde,o-phthaldehyde PubChem CID: 4807 ChEBI: CHEBI:70851 IUPAC Name: phthalaldehyde SMILES: O=CC1=CC=CC=C1C=O
| PubChem CID | 4807 |
|---|---|
| CAS | 643-79-8 |
| Molecular Weight (g/mol) | 134.13 |
| ChEBI | CHEBI:70851 |
| MDL Number | MFCD00003335 |
| SMILES | O=CC1=CC=CC=C1C=O |
| Synonym | o-phthalaldehyde,o-phthaldialdehyde,benzene-1,2-dicarboxaldehyde,1,2-benzenedicarboxaldehyde,phthaldialdehyde,phthalic aldehyde,phthalic dialdehyde,phthalyldicarboxaldehyde,ortho-phthalaldehyde,o-phthaldehyde |
| IUPAC Name | phthalaldehyde |
| InChI Key | ZWLUXSQADUDCSB-UHFFFAOYSA-N |
| Molecular Formula | C8H6O2 |
Eugenol, 99%
CAS: 97-53-0 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.20 MDL Number: MFCD00008654 InChI Key: RRAFCDWBNXTKKO-UHFFFAOYSA-N Synonym: eugenol,4-allylguaiacol,4-allyl-2-methoxyphenol,eugenic acid,allylguaiacol,caryophyllic acid,p-allylguaiacol,p-eugenol,2-methoxy-4-allylphenol,engenol PubChem CID: 3314 ChEBI: CHEBI:4917 SMILES: COC1=CC(CC=C)=CC=C1O
| PubChem CID | 3314 |
|---|---|
| CAS | 97-53-0 |
| Molecular Weight (g/mol) | 164.20 |
| ChEBI | CHEBI:4917 |
| MDL Number | MFCD00008654 |
| SMILES | COC1=CC(CC=C)=CC=C1O |
| Synonym | eugenol,4-allylguaiacol,4-allyl-2-methoxyphenol,eugenic acid,allylguaiacol,caryophyllic acid,p-allylguaiacol,p-eugenol,2-methoxy-4-allylphenol,engenol |
| InChI Key | RRAFCDWBNXTKKO-UHFFFAOYSA-N |
| Molecular Formula | C10H12O2 |
Benzyl chloride, 99%, stab.
CAS: 100-44-7 Molecular Formula: C7H7Cl Molecular Weight (g/mol): 126.583 MDL Number: MFCD00000889 InChI Key: KCXMKQUNVWSEMD-UHFFFAOYSA-N Synonym: benzyl chloride,chloromethyl benzene,benzylchloride,alpha-chlorotoluene,benzylchlorid,chlorophenylmethane,benzene, chloromethyl,chlorure de benzyle,tolyl chloride,alpha-chlortoluol PubChem CID: 7503 ChEBI: CHEBI:615597 IUPAC Name: chloromethylbenzene SMILES: C1=CC=C(C=C1)CCl
| PubChem CID | 7503 |
|---|---|
| CAS | 100-44-7 |
| Molecular Weight (g/mol) | 126.583 |
| ChEBI | CHEBI:615597 |
| MDL Number | MFCD00000889 |
| SMILES | C1=CC=C(C=C1)CCl |
| Synonym | benzyl chloride,chloromethyl benzene,benzylchloride,alpha-chlorotoluene,benzylchlorid,chlorophenylmethane,benzene, chloromethyl,chlorure de benzyle,tolyl chloride,alpha-chlortoluol |
| IUPAC Name | chloromethylbenzene |
| InChI Key | KCXMKQUNVWSEMD-UHFFFAOYSA-N |
| Molecular Formula | C7H7Cl |
2-Hydroxy-4-(methacryloyloxy)benzophenone, 99%
CAS: 2035-72-5 Molecular Formula: C17H14O4 Molecular Weight (g/mol): 282.295 MDL Number: MFCD00080561 InChI Key: IMNBHNRXUAJVQE-UHFFFAOYSA-N Synonym: 4-benzoyl-3-hydroxyphenyl methacrylate,4-methacryloxy-2-hydroxybenzophenone,2-hydroxy-4-methacryloyloxy benzophenone,methacrylic acid 4-benzoyl-3-hydroxyphenyl ester,3-hydroxy-4-phenylcarbonyl phenyl 2-methylprop-2-enoate,2-propenoic acid, 2-methyl-, 4-benzoyl-3-hydroxyphenyl ester,acmc-20amfp,2-hydroxy-4-methacryloxybenzophenone,2-hydroxy-4-methacryloyloxybenzophenone PubChem CID: 74856 IUPAC Name: (4-benzoyl-3-hydroxyphenyl) 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O
| PubChem CID | 74856 |
|---|---|
| CAS | 2035-72-5 |
| Molecular Weight (g/mol) | 282.295 |
| MDL Number | MFCD00080561 |
| SMILES | CC(=C)C(=O)OC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O |
| Synonym | 4-benzoyl-3-hydroxyphenyl methacrylate,4-methacryloxy-2-hydroxybenzophenone,2-hydroxy-4-methacryloyloxy benzophenone,methacrylic acid 4-benzoyl-3-hydroxyphenyl ester,3-hydroxy-4-phenylcarbonyl phenyl 2-methylprop-2-enoate,2-propenoic acid, 2-methyl-, 4-benzoyl-3-hydroxyphenyl ester,acmc-20amfp,2-hydroxy-4-methacryloxybenzophenone,2-hydroxy-4-methacryloyloxybenzophenone |
| IUPAC Name | (4-benzoyl-3-hydroxyphenyl) 2-methylprop-2-enoate |
| InChI Key | IMNBHNRXUAJVQE-UHFFFAOYSA-N |
| Molecular Formula | C17H14O4 |
Methyl 4-hydroxybenzoate, 99%
CAS: 99-76-3 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 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) | 152.15 |
| 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 |
Sulfasalazine, 97%
CAS: 599-79-1 Molecular Formula: C18H14N4O5S Molecular Weight (g/mol): 398.39 InChI Key: OQANPHBRHBJGNZ-BKUYFWCQSA-N IUPAC Name: (3Z)-6-oxo-3-(2-{4-[(pyridin-2-yl)sulfamoyl]phenyl}hydrazin-1-ylidene)cyclohexa-1,4-diene-1-carboxylic acid SMILES: OC(=O)C1=C\C(C=CC1=O)=N/NC1=CC=C(C=C1)S(=O)(=O)NC1=CC=CC=N1
| CAS | 599-79-1 |
|---|---|
| Molecular Weight (g/mol) | 398.39 |
| SMILES | OC(=O)C1=C\C(C=CC1=O)=N/NC1=CC=C(C=C1)S(=O)(=O)NC1=CC=CC=N1 |
| IUPAC Name | (3Z)-6-oxo-3-(2-{4-[(pyridin-2-yl)sulfamoyl]phenyl}hydrazin-1-ylidene)cyclohexa-1,4-diene-1-carboxylic acid |
| InChI Key | OQANPHBRHBJGNZ-BKUYFWCQSA-N |
| Molecular Formula | C18H14N4O5S |
4-tert-Amylphenol, 99%
CAS: 80-46-6 Molecular Formula: C11H16O Molecular Weight (g/mol): 164.25 MDL Number: MFCD00002369 InChI Key: NRZWYNLTFLDQQX-UHFFFAOYSA-N Synonym: 4-tert-amylphenol,4-tert-pentylphenol,p-tert-amylphenol,p-tert-pentylphenol,4-t-amylphenol,4-1,1-dimethylpropyl phenol,amilphenol,amilfenol,pentaphen,tert-amylphenol PubChem CID: 6643 ChEBI: CHEBI:35096 IUPAC Name: 4-(2-methylbutan-2-yl)phenol SMILES: CCC(C)(C)C1=CC=C(C=C1)O
| PubChem CID | 6643 |
|---|---|
| CAS | 80-46-6 |
| Molecular Weight (g/mol) | 164.25 |
| ChEBI | CHEBI:35096 |
| MDL Number | MFCD00002369 |
| SMILES | CCC(C)(C)C1=CC=C(C=C1)O |
| Synonym | 4-tert-amylphenol,4-tert-pentylphenol,p-tert-amylphenol,p-tert-pentylphenol,4-t-amylphenol,4-1,1-dimethylpropyl phenol,amilphenol,amilfenol,pentaphen,tert-amylphenol |
| IUPAC Name | 4-(2-methylbutan-2-yl)phenol |
| InChI Key | NRZWYNLTFLDQQX-UHFFFAOYSA-N |
| Molecular Formula | C11H16O |
p-Toluenesulfonic Acid, Monohydrate , MP Biomedical
CAS: 104-15-4 Molecular Formula: C7H8O3S Molecular Weight (g/mol): 172.20 InChI Key: JOXIMZWYDAKGHI-UHFFFAOYSA-N Synonym: p-toluenesulfonic acid,p-toluenesulphonic acid,4-toluenesulfonic acid,tosic acid,p-tolylsulfonic acid,toluene-4-sulfonic acid,toluenesulfonic acid,benzenesulfonic acid, 4-methyl,p-toluenesulfonate,eltesol PubChem CID: 6101 ChEBI: CHEBI:27849
| PubChem CID | 6101 |
|---|---|
| CAS | 104-15-4 |
| Molecular Weight (g/mol) | 172.20 |
| ChEBI | CHEBI:27849 |
| Synonym | p-toluenesulfonic acid,p-toluenesulphonic acid,4-toluenesulfonic acid,tosic acid,p-tolylsulfonic acid,toluene-4-sulfonic acid,toluenesulfonic acid,benzenesulfonic acid, 4-methyl,p-toluenesulfonate,eltesol |
| InChI Key | JOXIMZWYDAKGHI-UHFFFAOYSA-N |
| Molecular Formula | C7H8O3S |
3,4-Dimethoxybenzyl alcohol, 97%
CAS: 93-03-8 Molecular Formula: C9H12O3 Molecular Weight (g/mol): 168.192 MDL Number: MFCD00004638 InChI Key: OEGPRYNGFWGMMV-UHFFFAOYSA-N Synonym: 3,4-dimethoxybenzyl alcohol,veratryl alcohol,3,4-dimethoxyphenyl methanol,benzenemethanol, 3,4-dimethoxy,3,4-dimethoxyphenylmethyl alcohol,veratrole alcohol,3,4-dimethoxybenzenemethanol,unii-mb4t4a711h,3,4-dimethoxyphenyl-methanol PubChem CID: 7118 ChEBI: CHEBI:62150 IUPAC Name: (3,4-dimethoxyphenyl)methanol SMILES: COC1=C(C=C(C=C1)CO)OC
| PubChem CID | 7118 |
|---|---|
| CAS | 93-03-8 |
| Molecular Weight (g/mol) | 168.192 |
| ChEBI | CHEBI:62150 |
| MDL Number | MFCD00004638 |
| SMILES | COC1=C(C=C(C=C1)CO)OC |
| Synonym | 3,4-dimethoxybenzyl alcohol,veratryl alcohol,3,4-dimethoxyphenyl methanol,benzenemethanol, 3,4-dimethoxy,3,4-dimethoxyphenylmethyl alcohol,veratrole alcohol,3,4-dimethoxybenzenemethanol,unii-mb4t4a711h,3,4-dimethoxyphenyl-methanol |
| IUPAC Name | (3,4-dimethoxyphenyl)methanol |
| InChI Key | OEGPRYNGFWGMMV-UHFFFAOYSA-N |
| Molecular Formula | C9H12O3 |