Benzene and substituted derivatives
Filtered Search Results
3-Chlorobenzylideneacetone, 98%
CAS: 20766-36-3 Molecular Formula: C10H9ClO Molecular Weight (g/mol): 180.631 MDL Number: MFCD00052851 InChI Key: VWEPXSRBBXPYSM-AATRIKPKSA-N Synonym: 3e-4-3-chlorophenyl but-3-en-2-one,e-4-3-chloro-phenyl-but-3-en-2-one,4-3-chlorophenyl but-3-en-2-one,e-4-3-chlorophenyl-but-3-en-2-one,3-chlorobenzylideneacetone,3-chloro-benzalacetone,3-chlorostyrylmethyl ketone,3-chlorobenzylidene acetone,chembl73680,e-4-3-chlorophenyl but-3-en-2-one PubChem CID: 5373975 IUPAC Name: (E)-4-(3-chlorophenyl)but-3-en-2-one SMILES: CC(=O)C=CC1=CC(=CC=C1)Cl
| PubChem CID | 5373975 |
|---|---|
| CAS | 20766-36-3 |
| Molecular Weight (g/mol) | 180.631 |
| MDL Number | MFCD00052851 |
| SMILES | CC(=O)C=CC1=CC(=CC=C1)Cl |
| Synonym | 3e-4-3-chlorophenyl but-3-en-2-one,e-4-3-chloro-phenyl-but-3-en-2-one,4-3-chlorophenyl but-3-en-2-one,e-4-3-chlorophenyl-but-3-en-2-one,3-chlorobenzylideneacetone,3-chloro-benzalacetone,3-chlorostyrylmethyl ketone,3-chlorobenzylidene acetone,chembl73680,e-4-3-chlorophenyl but-3-en-2-one |
| IUPAC Name | (E)-4-(3-chlorophenyl)but-3-en-2-one |
| InChI Key | VWEPXSRBBXPYSM-AATRIKPKSA-N |
| Molecular Formula | C10H9ClO |
4-Methylstyrene, 98%, stab. with 0.1% 3,5-di-tert-butylcatechol
CAS: 622-97-9 Molecular Formula: C9H10 Molecular Weight (g/mol): 118.18 MDL Number: MFCD00008621 InChI Key: JLBJTVDPSNHSKJ-UHFFFAOYSA-N Synonym: 4-methylstyrene,1-methyl-4-vinylbenzene,p-methylstyrene,4-vinyltoluene,p-vinyltoluene,benzene, 1-ethenyl-4-methyl,styrene, p-methyl,p-methyl styrene,1-p-tolylethene,para-methylstyrene PubChem CID: 12161 IUPAC Name: 1-ethenyl-4-methylbenzene SMILES: CC1=CC=C(C=C)C=C1
| PubChem CID | 12161 |
|---|---|
| CAS | 622-97-9 |
| Molecular Weight (g/mol) | 118.18 |
| MDL Number | MFCD00008621 |
| SMILES | CC1=CC=C(C=C)C=C1 |
| Synonym | 4-methylstyrene,1-methyl-4-vinylbenzene,p-methylstyrene,4-vinyltoluene,p-vinyltoluene,benzene, 1-ethenyl-4-methyl,styrene, p-methyl,p-methyl styrene,1-p-tolylethene,para-methylstyrene |
| IUPAC Name | 1-ethenyl-4-methylbenzene |
| InChI Key | JLBJTVDPSNHSKJ-UHFFFAOYSA-N |
| Molecular Formula | C9H10 |
3-Vinylbenzoic acid, 96%
CAS: 28447-20-3 Molecular Formula: C9H8O2 Molecular Weight (g/mol): 148.161 MDL Number: MFCD00157038 InChI Key: VWXZFDWVWMQRQR-UHFFFAOYSA-N PubChem CID: 4438231 IUPAC Name: 3-ethenylbenzoic acid SMILES: C=CC1=CC(=CC=C1)C(=O)O
| PubChem CID | 4438231 |
|---|---|
| CAS | 28447-20-3 |
| Molecular Weight (g/mol) | 148.161 |
| MDL Number | MFCD00157038 |
| SMILES | C=CC1=CC(=CC=C1)C(=O)O |
| IUPAC Name | 3-ethenylbenzoic acid |
| InChI Key | VWXZFDWVWMQRQR-UHFFFAOYSA-N |
| Molecular Formula | C9H8O2 |
2-Iodobenzyl alcohol, 99%
CAS: 5159-41-1 Molecular Formula: C7H7IO Molecular Weight (g/mol): 234.04 MDL Number: MFCD00004610 InChI Key: WZCXOBMFBKSSFA-UHFFFAOYSA-N Synonym: 2-iodobenzyl alcohol,2-iodophenyl methanol,o-iodobenzyl alcohol,2-iodobenzylalcohol,benzenemethanol, 2-iodo,2-iodobenzylic alcohol,2-jod-benzylalkohol,o-iodo benzylalcohol,2-iodo-benzyl alcohol PubChem CID: 107629 IUPAC Name: (2-iodophenyl)methanol SMILES: C1=CC=C(C(=C1)CO)I
| PubChem CID | 107629 |
|---|---|
| CAS | 5159-41-1 |
| Molecular Weight (g/mol) | 234.04 |
| MDL Number | MFCD00004610 |
| SMILES | C1=CC=C(C(=C1)CO)I |
| Synonym | 2-iodobenzyl alcohol,2-iodophenyl methanol,o-iodobenzyl alcohol,2-iodobenzylalcohol,benzenemethanol, 2-iodo,2-iodobenzylic alcohol,2-jod-benzylalkohol,o-iodo benzylalcohol,2-iodo-benzyl alcohol |
| IUPAC Name | (2-iodophenyl)methanol |
| InChI Key | WZCXOBMFBKSSFA-UHFFFAOYSA-N |
| Molecular Formula | C7H7IO |
3,4-Dimethoxybenzyl alcohol, 96%
CAS: 93-03-8 Molecular Formula: C9H12O3 Molecular Weight (g/mol): 168.19 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) | 168.19 |
| ChEBI | CHEBI:62150 |
| 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 |
Thermo Scientific Chemicals 4-(Dicyanomethylene)-2-methyl-6-(p-dimethylaminostyryl)-4H-pyran, 96+%
CAS: 51325-91-8 Molecular Formula: C19H17N3O Molecular Weight (g/mol): 303.35 MDL Number: MFCD00051341 InChI Key: YLYPIBBGWLKELC-RMKNXTFCSA-N Synonym: unii-9s1wxc1zgn,dcm dye,dcm1,9s1wxc1zgn,4-dicyanomethylene-2-methyl-6-4-dimethylaminostyryl-4h-pyran,4-dicyanomethylene-2-methyl-6-4-dimethylamino styryl-4h-pyran,e-2-2-4-dimethylamino styryl-6-methyl-4h-pyran-4-ylidene malononitrile,2-2-4-dimethylamino phenyl ethenyl-6-methyl-4h-pyran-4-ylidene propanedinitrile,2-2-4-dimethylamino styryl-6-methyl-4h-pyran-4-ylidene malononitrile PubChem CID: 688222 IUPAC Name: 2-[2-[(E)-2-[4-(dimethylamino)phenyl]ethenyl]-6-methylpyran-4-ylidene]propanedinitrile SMILES: CC1=CC(=C(C#N)C#N)C=C(O1)C=CC2=CC=C(C=C2)N(C)C
| PubChem CID | 688222 |
|---|---|
| CAS | 51325-91-8 |
| Molecular Weight (g/mol) | 303.35 |
| MDL Number | MFCD00051341 |
| SMILES | CC1=CC(=C(C#N)C#N)C=C(O1)C=CC2=CC=C(C=C2)N(C)C |
| Synonym | unii-9s1wxc1zgn,dcm dye,dcm1,9s1wxc1zgn,4-dicyanomethylene-2-methyl-6-4-dimethylaminostyryl-4h-pyran,4-dicyanomethylene-2-methyl-6-4-dimethylamino styryl-4h-pyran,e-2-2-4-dimethylamino styryl-6-methyl-4h-pyran-4-ylidene malononitrile,2-2-4-dimethylamino phenyl ethenyl-6-methyl-4h-pyran-4-ylidene propanedinitrile,2-2-4-dimethylamino styryl-6-methyl-4h-pyran-4-ylidene malononitrile |
| IUPAC Name | 2-[2-[(E)-2-[4-(dimethylamino)phenyl]ethenyl]-6-methylpyran-4-ylidene]propanedinitrile |
| InChI Key | YLYPIBBGWLKELC-RMKNXTFCSA-N |
| Molecular Formula | C19H17N3O |
4-Bromobenzyl alcohol, 99%
CAS: 873-75-6 Molecular Formula: C7H7BrO Molecular Weight (g/mol): 187.04 MDL Number: MFCD00004650 InChI Key: VEDDBHYQWFOITD-UHFFFAOYSA-N Synonym: 4-bromobenzyl alcohol,4-bromophenyl methanol,p-bromobenzyl alcohol,benzenemethanol, 4-bromo,para-bromobenzyl alcohol,4-bromobenzylalcohol,p-bromo-benzyl alcohol,ccris 5119,4-bromophenyl-methanol,benzyl alcohol, p-bromo PubChem CID: 70119 IUPAC Name: (4-bromophenyl)methanol SMILES: C1=CC(=CC=C1CO)Br
| PubChem CID | 70119 |
|---|---|
| CAS | 873-75-6 |
| Molecular Weight (g/mol) | 187.04 |
| MDL Number | MFCD00004650 |
| SMILES | C1=CC(=CC=C1CO)Br |
| Synonym | 4-bromobenzyl alcohol,4-bromophenyl methanol,p-bromobenzyl alcohol,benzenemethanol, 4-bromo,para-bromobenzyl alcohol,4-bromobenzylalcohol,p-bromo-benzyl alcohol,ccris 5119,4-bromophenyl-methanol,benzyl alcohol, p-bromo |
| IUPAC Name | (4-bromophenyl)methanol |
| InChI Key | VEDDBHYQWFOITD-UHFFFAOYSA-N |
| Molecular Formula | C7H7BrO |
Pentafluorobenzoyl chloride, 98%
CAS: 2251-50-5 Molecular Formula: C7ClF5O Molecular Weight (g/mol): 230.52 MDL Number: MFCD00000657 InChI Key: MYHOHFDYWMPGJY-UHFFFAOYSA-N Synonym: pentafluorobenzoyl chloride,perfluorobenzoyl chloride,benzoyl chloride, pentafluoro,pentafluorobenzoylchloride,pubchem15522,acmc-1covi,intermediates-zcf02601,pentafluorobenzoic acid chloride,attercop-chm at133861,67924-15-6 unspecified acetate PubChem CID: 75256 ChEBI: CHEBI:39425 SMILES: FC1=C(F)C(F)=C(C(Cl)=O)C(F)=C1F
| PubChem CID | 75256 |
|---|---|
| CAS | 2251-50-5 |
| Molecular Weight (g/mol) | 230.52 |
| ChEBI | CHEBI:39425 |
| MDL Number | MFCD00000657 |
| SMILES | FC1=C(F)C(F)=C(C(Cl)=O)C(F)=C1F |
| Synonym | pentafluorobenzoyl chloride,perfluorobenzoyl chloride,benzoyl chloride, pentafluoro,pentafluorobenzoylchloride,pubchem15522,acmc-1covi,intermediates-zcf02601,pentafluorobenzoic acid chloride,attercop-chm at133861,67924-15-6 unspecified acetate |
| InChI Key | MYHOHFDYWMPGJY-UHFFFAOYSA-N |
| Molecular Formula | C7ClF5O |
3,5-Dimethylphenylacetonitrile, 98%
CAS: 39101-54-7 Molecular Formula: C10H11N Molecular Weight (g/mol): 145.205 MDL Number: MFCD00060304 InChI Key: LMUKNQSVBFEUKR-UHFFFAOYSA-N Synonym: 3,5-dimethylphenylacetonitrile,2-3,5-dimethylphenyl acetonitrile,3,5-dimethylphenyl acetonitrile,benzeneacetonitrile, 3,5-dimethyl,3,5-dimethyl-phenyl-acetonitrile,2-3,5-dimethylphenyl ethanenitrile,acmc-20a3vm,3.5-dimethylphenylacetonitril,3,5-dimethylbenzeneacetonitrile,3,5-dimethylphenylethanenitrile PubChem CID: 123481 IUPAC Name: 2-(3,5-dimethylphenyl)acetonitrile SMILES: CC1=CC(=CC(=C1)CC#N)C
| PubChem CID | 123481 |
|---|---|
| CAS | 39101-54-7 |
| Molecular Weight (g/mol) | 145.205 |
| MDL Number | MFCD00060304 |
| SMILES | CC1=CC(=CC(=C1)CC#N)C |
| Synonym | 3,5-dimethylphenylacetonitrile,2-3,5-dimethylphenyl acetonitrile,3,5-dimethylphenyl acetonitrile,benzeneacetonitrile, 3,5-dimethyl,3,5-dimethyl-phenyl-acetonitrile,2-3,5-dimethylphenyl ethanenitrile,acmc-20a3vm,3.5-dimethylphenylacetonitril,3,5-dimethylbenzeneacetonitrile,3,5-dimethylphenylethanenitrile |
| IUPAC Name | 2-(3,5-dimethylphenyl)acetonitrile |
| InChI Key | LMUKNQSVBFEUKR-UHFFFAOYSA-N |
| Molecular Formula | C10H11N |
3,3'-Diaminobenzophenone, 90%
CAS: 611-79-0 Molecular Formula: C13H12N2O Molecular Weight (g/mol): 212.25 MDL Number: MFCD00014774 InChI Key: TUQQUUXMCKXGDI-UHFFFAOYSA-N Synonym: 3,3'-diaminobenzophenone,bis 3-aminophenyl methanone,methanone, bis 3-aminophenyl,di3-aminophenyl ketone,3,3'-diaminodiphenyl ketone,pubchem3381,acmc-1awhc,cbmicro_014188,3,3'-diamino benzophenone,3-3-aminobenzoyl aniline PubChem CID: 69145 IUPAC Name: bis(3-aminophenyl)methanone SMILES: NC1=CC(=CC=C1)C(=O)C1=CC(N)=CC=C1
| PubChem CID | 69145 |
|---|---|
| CAS | 611-79-0 |
| Molecular Weight (g/mol) | 212.25 |
| MDL Number | MFCD00014774 |
| SMILES | NC1=CC(=CC=C1)C(=O)C1=CC(N)=CC=C1 |
| Synonym | 3,3'-diaminobenzophenone,bis 3-aminophenyl methanone,methanone, bis 3-aminophenyl,di3-aminophenyl ketone,3,3'-diaminodiphenyl ketone,pubchem3381,acmc-1awhc,cbmicro_014188,3,3'-diamino benzophenone,3-3-aminobenzoyl aniline |
| IUPAC Name | bis(3-aminophenyl)methanone |
| InChI Key | TUQQUUXMCKXGDI-UHFFFAOYSA-N |
| Molecular Formula | C13H12N2O |
m-Toluic hydrazide, 97%
CAS: 13050-47-0 Molecular Formula: C8H10N2O Molecular Weight (g/mol): 150.18 MDL Number: MFCD00014760 InChI Key: XFNNAMBYJSQXKF-UHFFFAOYSA-N Synonym: m-toluic acid hydrazide,3-toluic hydrazide,m-toluic hydrazide,m-toluohydrazide,3-methylbenzoylhydrazide,3-methyl-benzoylhydrazide,benzoylhydrazine, m-methyl,3-methyl-benzoic acid hydrazide,benzoic acid, 3-methyl-, hydrazide,3-methylbenzenecarbohydrazide PubChem CID: 83082 IUPAC Name: 3-methylbenzohydrazide SMILES: CC1=CC=CC(=C1)C(=O)NN
| PubChem CID | 83082 |
|---|---|
| CAS | 13050-47-0 |
| Molecular Weight (g/mol) | 150.18 |
| MDL Number | MFCD00014760 |
| SMILES | CC1=CC=CC(=C1)C(=O)NN |
| Synonym | m-toluic acid hydrazide,3-toluic hydrazide,m-toluic hydrazide,m-toluohydrazide,3-methylbenzoylhydrazide,3-methyl-benzoylhydrazide,benzoylhydrazine, m-methyl,3-methyl-benzoic acid hydrazide,benzoic acid, 3-methyl-, hydrazide,3-methylbenzenecarbohydrazide |
| IUPAC Name | 3-methylbenzohydrazide |
| InChI Key | XFNNAMBYJSQXKF-UHFFFAOYSA-N |
| Molecular Formula | C8H10N2O |
2,5-Dimethoxyaniline, 99%
CAS: 102-56-7 Molecular Formula: C8H11NO2 Molecular Weight (g/mol): 153.18 MDL Number: MFCD00008368 InChI Key: NAZDVUBIEPVUKE-UHFFFAOYSA-N Synonym: benzenamine, 2,5-dimethoxy,aminohydroquinone dimethyl ether,1-amino-2,5-dimethoxybenzene,2,5-dimethoxybenzenamine,aniline, 2,5-dimethoxy,unii-v3z5u3fl10,2,5 dimethoxyaniline,2,5-dimethoxyphenylamine,dimethoxyaniline 2,5-,2,5-dimethoxy aniline PubChem CID: 7613 IUPAC Name: 2,5-dimethoxyaniline SMILES: COC1=CC=C(OC)C(N)=C1
| PubChem CID | 7613 |
|---|---|
| CAS | 102-56-7 |
| Molecular Weight (g/mol) | 153.18 |
| MDL Number | MFCD00008368 |
| SMILES | COC1=CC=C(OC)C(N)=C1 |
| Synonym | benzenamine, 2,5-dimethoxy,aminohydroquinone dimethyl ether,1-amino-2,5-dimethoxybenzene,2,5-dimethoxybenzenamine,aniline, 2,5-dimethoxy,unii-v3z5u3fl10,2,5 dimethoxyaniline,2,5-dimethoxyphenylamine,dimethoxyaniline 2,5-,2,5-dimethoxy aniline |
| IUPAC Name | 2,5-dimethoxyaniline |
| InChI Key | NAZDVUBIEPVUKE-UHFFFAOYSA-N |
| Molecular Formula | C8H11NO2 |
2-(Difluoromethoxy)benzylamine, 97%, Thermo Scientific Chemicals
CAS: 243863-36-7 Molecular Formula: C8H9F2NO Molecular Weight (g/mol): 173.163 MDL Number: MFCD00236229 InChI Key: GGXXUJUQXAOYPK-UHFFFAOYSA-N Synonym: 2-difluoromethoxy benzylamine,2-difluoromethoxy phenyl methanamine,1-2-difluoromethoxy phenyl methanamine,benzenemethanamine, 2-difluoromethoxy,2-difluoromethoxy phenyl methylamine,acmc-20a5tk,2-difluoromethoxy-benzylamine,2-difluoromethoxy benzyl amine PubChem CID: 1514062 IUPAC Name: [2-(difluoromethoxy)phenyl]methanamine SMILES: C1=CC=C(C(=C1)CN)OC(F)F
| PubChem CID | 1514062 |
|---|---|
| CAS | 243863-36-7 |
| Molecular Weight (g/mol) | 173.163 |
| MDL Number | MFCD00236229 |
| SMILES | C1=CC=C(C(=C1)CN)OC(F)F |
| Synonym | 2-difluoromethoxy benzylamine,2-difluoromethoxy phenyl methanamine,1-2-difluoromethoxy phenyl methanamine,benzenemethanamine, 2-difluoromethoxy,2-difluoromethoxy phenyl methylamine,acmc-20a5tk,2-difluoromethoxy-benzylamine,2-difluoromethoxy benzyl amine |
| IUPAC Name | [2-(difluoromethoxy)phenyl]methanamine |
| InChI Key | GGXXUJUQXAOYPK-UHFFFAOYSA-N |
| Molecular Formula | C8H9F2NO |
3-Iodophenylacetic acid, 98%
CAS: 1878-69-9 Molecular Formula: C8H7IO2 Molecular Weight (g/mol): 262.05 MDL Number: MFCD00046548 InChI Key: MRSWWBAFGGGWRH-UHFFFAOYSA-N Synonym: 3-iodophenylacetic acid,2-3-iodophenyl acetic acid,3-iodophenyl acetic acid,m-iodophenylacetic acid,m-iodobenzeneacetic acid,benzeneacetic acid, 3-iodo,pubchem4195,3-iodophenylaceticacid,acmc-1cfam,3-iodobenzeneacetic acid PubChem CID: 3870220 IUPAC Name: 2-(3-iodophenyl)acetic acid SMILES: OC(=O)CC1=CC(I)=CC=C1
| PubChem CID | 3870220 |
|---|---|
| CAS | 1878-69-9 |
| Molecular Weight (g/mol) | 262.05 |
| MDL Number | MFCD00046548 |
| SMILES | OC(=O)CC1=CC(I)=CC=C1 |
| Synonym | 3-iodophenylacetic acid,2-3-iodophenyl acetic acid,3-iodophenyl acetic acid,m-iodophenylacetic acid,m-iodobenzeneacetic acid,benzeneacetic acid, 3-iodo,pubchem4195,3-iodophenylaceticacid,acmc-1cfam,3-iodobenzeneacetic acid |
| IUPAC Name | 2-(3-iodophenyl)acetic acid |
| InChI Key | MRSWWBAFGGGWRH-UHFFFAOYSA-N |
| Molecular Formula | C8H7IO2 |
Bromopentamethylbenzene, 98%
CAS: 5153-40-2 Molecular Formula: C11H15Br Molecular Weight (g/mol): 227.15 MDL Number: MFCD00013523 InChI Key: XPDQRULPGCFCLX-UHFFFAOYSA-N Synonym: bromopentamethylbenzene,benzene, bromopentamethyl,pentamethylbromobenzene,1-bromopentamethylbenzene,1-bromo-2,3,4,5,6-pentamethyl-benzene,brompentamethylbenzol,maybridge1_002545,ksc273s6f,acmc-1b227,5-bromo-1,2,3,4,6-pentamethylbenzene PubChem CID: 78831 IUPAC Name: 1-bromo-2,3,4,5,6-pentamethylbenzene SMILES: CC1=C(C)C(C)=C(Br)C(C)=C1C
| PubChem CID | 78831 |
|---|---|
| CAS | 5153-40-2 |
| Molecular Weight (g/mol) | 227.15 |
| MDL Number | MFCD00013523 |
| SMILES | CC1=C(C)C(C)=C(Br)C(C)=C1C |
| Synonym | bromopentamethylbenzene,benzene, bromopentamethyl,pentamethylbromobenzene,1-bromopentamethylbenzene,1-bromo-2,3,4,5,6-pentamethyl-benzene,brompentamethylbenzol,maybridge1_002545,ksc273s6f,acmc-1b227,5-bromo-1,2,3,4,6-pentamethylbenzene |
| IUPAC Name | 1-bromo-2,3,4,5,6-pentamethylbenzene |
| InChI Key | XPDQRULPGCFCLX-UHFFFAOYSA-N |
| Molecular Formula | C11H15Br |