Benzenoids
Filtered Search Results
Thermo Scientific Chemicals Citalopram hydrobromide
CAS: 59729-32-7 Molecular Formula: C20H21FN2O·HBr Molecular Weight (g/mol): 405.3 InChI Key: WIHMBLDNRMIGDW-UHFFFAOYSA-N Synonym: citalopram hydrobromide,citalopram hbr,cipramil,celexa,1-3-dimethylamino propyl-1-4-fluorophenyl-1,3-dihydroisobenzofuran-5-carbonitrile hydrobromide,elopram,seropram,1-3-dimethylamino propyl-1-4-fluorophenyl-1,3-dihydro-5-isobenzofurancarbonitrile hydrobromide,citalopram hydrobromide usan PubChem CID: 77995 IUPAC Name: 1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile;hydrobromide SMILES: CN(C)CCCC1(C2=C(CO1)C=C(C=C2)C#N)C3=CC=C(C=C3)F.Br
| PubChem CID | 77995 |
|---|---|
| CAS | 59729-32-7 |
| Molecular Weight (g/mol) | 405.3 |
| SMILES | CN(C)CCCC1(C2=C(CO1)C=C(C=C2)C#N)C3=CC=C(C=C3)F.Br |
| Synonym | citalopram hydrobromide,citalopram hbr,cipramil,celexa,1-3-dimethylamino propyl-1-4-fluorophenyl-1,3-dihydroisobenzofuran-5-carbonitrile hydrobromide,elopram,seropram,1-3-dimethylamino propyl-1-4-fluorophenyl-1,3-dihydro-5-isobenzofurancarbonitrile hydrobromide,citalopram hydrobromide usan |
| IUPAC Name | 1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile;hydrobromide |
| InChI Key | WIHMBLDNRMIGDW-UHFFFAOYSA-N |
| Molecular Formula | C20H21FN2O·HBr |
2-Methoxybenzyl alcohol, 99%
CAS: 612-16-8 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.17 MDL Number: MFCD00004611 InChI Key: WYLYBQSHRJMURN-UHFFFAOYSA-N Synonym: 2-methoxybenzyl alcohol,2-methoxyphenyl methanol,o-methoxybenzyl alcohol,benzenemethanol, 2-methoxy,o-anisyl alcohol,2-methoxybenzylalcohol,2-methoxybenzenemethanol,unii-457nq8ngcg,457nq8ngcg,2-methoxyphenyl methan-1-ol PubChem CID: 69154 IUPAC Name: (2-methoxyphenyl)methanol SMILES: COC1=CC=CC=C1CO
| PubChem CID | 69154 |
|---|---|
| CAS | 612-16-8 |
| Molecular Weight (g/mol) | 138.17 |
| MDL Number | MFCD00004611 |
| SMILES | COC1=CC=CC=C1CO |
| Synonym | 2-methoxybenzyl alcohol,2-methoxyphenyl methanol,o-methoxybenzyl alcohol,benzenemethanol, 2-methoxy,o-anisyl alcohol,2-methoxybenzylalcohol,2-methoxybenzenemethanol,unii-457nq8ngcg,457nq8ngcg,2-methoxyphenyl methan-1-ol |
| IUPAC Name | (2-methoxyphenyl)methanol |
| InChI Key | WYLYBQSHRJMURN-UHFFFAOYSA-N |
| Molecular Formula | C8H10O2 |
n-Heptyl 4-hydroxybenzoate, 98%
CAS: 1085-12-7 Molecular Formula: C14H20O3 Molecular Weight (g/mol): 236.31 MDL Number: MFCD00016481 InChI Key: ZTJORNVITHUQJA-UHFFFAOYSA-N Synonym: heptylparaben,heptyl paraben,heptyl p-hydroxybenzoate,n-heptyl 4-hydroxybenzoate,nipaheptyl,staypro ws 7,n-heptyl p-hydroxybenzoate,benzoic acid, 4-hydroxy-, heptyl ester,p-hydroxybenzoic acid heptyl ester,p-oxybenzoesaureheptylester PubChem CID: 14138 ChEBI: CHEBI:34788 IUPAC Name: heptyl 4-hydroxybenzoate SMILES: CCCCCCCOC(=O)C1=CC=C(O)C=C1
| PubChem CID | 14138 |
|---|---|
| CAS | 1085-12-7 |
| Molecular Weight (g/mol) | 236.31 |
| ChEBI | CHEBI:34788 |
| MDL Number | MFCD00016481 |
| SMILES | CCCCCCCOC(=O)C1=CC=C(O)C=C1 |
| Synonym | heptylparaben,heptyl paraben,heptyl p-hydroxybenzoate,n-heptyl 4-hydroxybenzoate,nipaheptyl,staypro ws 7,n-heptyl p-hydroxybenzoate,benzoic acid, 4-hydroxy-, heptyl ester,p-hydroxybenzoic acid heptyl ester,p-oxybenzoesaureheptylester |
| IUPAC Name | heptyl 4-hydroxybenzoate |
| InChI Key | ZTJORNVITHUQJA-UHFFFAOYSA-N |
| Molecular Formula | C14H20O3 |
3-(Boc-amino)phenol, 97%
CAS: 19962-06-2 Molecular Formula: C11H15NO3 Molecular Weight (g/mol): 209.25 MDL Number: MFCD06798070 InChI Key: HJQNVUQTARSZDK-UHFFFAOYSA-N Synonym: tert-butyl 3-hydroxyphenylcarbamate,3-boc-amino phenol,tert-butyl n-3-hydroxyphenyl carbamate,tert-butyl 3-hydroxyphenyl carbamate,n-boc-3-aminophenol,carbamic acid, 3-hydroxyphenyl-, 1,1-dimethylethyl ester,carbamic acid, n-3-hydroxyphenyl-, 1,1-dimethylethyl ester,carbamic acid,n-3-hydroxyphenyl-, 1,1-dimethylethyl ester,tert-butoxy-n-3-hydroxyphenyl carboxamide,n-boc-3-amino-phenol PubChem CID: 312485 IUPAC Name: tert-butyl N-(3-hydroxyphenyl)carbamate SMILES: CC(C)(C)OC(=O)NC1=CC=CC(O)=C1
| PubChem CID | 312485 |
|---|---|
| CAS | 19962-06-2 |
| Molecular Weight (g/mol) | 209.25 |
| MDL Number | MFCD06798070 |
| SMILES | CC(C)(C)OC(=O)NC1=CC=CC(O)=C1 |
| Synonym | tert-butyl 3-hydroxyphenylcarbamate,3-boc-amino phenol,tert-butyl n-3-hydroxyphenyl carbamate,tert-butyl 3-hydroxyphenyl carbamate,n-boc-3-aminophenol,carbamic acid, 3-hydroxyphenyl-, 1,1-dimethylethyl ester,carbamic acid, n-3-hydroxyphenyl-, 1,1-dimethylethyl ester,carbamic acid,n-3-hydroxyphenyl-, 1,1-dimethylethyl ester,tert-butoxy-n-3-hydroxyphenyl carboxamide,n-boc-3-amino-phenol |
| IUPAC Name | tert-butyl N-(3-hydroxyphenyl)carbamate |
| InChI Key | HJQNVUQTARSZDK-UHFFFAOYSA-N |
| Molecular Formula | C11H15NO3 |
Methoxychlor
CAS: 72-43-5 Molecular Formula: C16H15Cl3O2 Molecular Weight (g/mol): 345.644 MDL Number: MFCD00000803 InChI Key: IAKOZHOLGAGEJT-UHFFFAOYSA-N Synonym: methoxychlor,p,p'-methoxychlor,dmdt,dimethoxy-ddt,methoxy-ddt,methoxcide,metox,maralate,marlate,moxie PubChem CID: 4115 ChEBI: CHEBI:6842 IUPAC Name: 1-methoxy-4-[2,2,2-trichloro-1-(4-methoxyphenyl)ethyl]benzene SMILES: COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)C(Cl)(Cl)Cl
| PubChem CID | 4115 |
|---|---|
| CAS | 72-43-5 |
| Molecular Weight (g/mol) | 345.644 |
| ChEBI | CHEBI:6842 |
| MDL Number | MFCD00000803 |
| SMILES | COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)C(Cl)(Cl)Cl |
| Synonym | methoxychlor,p,p'-methoxychlor,dmdt,dimethoxy-ddt,methoxy-ddt,methoxcide,metox,maralate,marlate,moxie |
| IUPAC Name | 1-methoxy-4-[2,2,2-trichloro-1-(4-methoxyphenyl)ethyl]benzene |
| InChI Key | IAKOZHOLGAGEJT-UHFFFAOYSA-N |
| Molecular Formula | C16H15Cl3O2 |
2-Phenoxyethanol, MP Biomedicals™
CAS: 122-99-6 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.166 InChI Key: QCDWFXQBSFUVSP-UHFFFAOYSA-N Synonym: phenoxyethanol,ethylene glycol monophenyl ether,phenyl cellosolve,ethanol, 2-phenoxy,phenoxytol,phenoxethol,phenoxetol,ethylene glycol phenyl ether,phenoxyethyl alcohol,1-hydroxy-2-phenoxyethane PubChem CID: 31236 ChEBI: CHEBI:64275 IUPAC Name: 2-phenoxyethanol SMILES: C1=CC=C(C=C1)OCCO
| PubChem CID | 31236 |
|---|---|
| CAS | 122-99-6 |
| Molecular Weight (g/mol) | 138.166 |
| ChEBI | CHEBI:64275 |
| SMILES | C1=CC=C(C=C1)OCCO |
| Synonym | phenoxyethanol,ethylene glycol monophenyl ether,phenyl cellosolve,ethanol, 2-phenoxy,phenoxytol,phenoxethol,phenoxetol,ethylene glycol phenyl ether,phenoxyethyl alcohol,1-hydroxy-2-phenoxyethane |
| IUPAC Name | 2-phenoxyethanol |
| InChI Key | QCDWFXQBSFUVSP-UHFFFAOYSA-N |
| Molecular Formula | C8H10O2 |
Thermo Scientific Chemicals (±)-Verapamil hydrochloride, 99+%
CAS: 152-11-4 Molecular Formula: C27H38N2O4·HCl Molecular Weight (g/mol): 491.07 MDL Number: MFCD00055208 InChI Key: DOQPXTMNIUCOSY-UHFFFAOYSA-N Synonym: verapamil hydrochloride,verapamil hcl,manidon,calcan hydrochloride,cardibeltin,cardiabeltin,cardioprotect,veroptinstada,calaptin,caveril PubChem CID: 62969 IUPAC Name: 2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-propan-2-ylpentanenitrile;hydrochloride SMILES: CC(C)C(CCCN(C)CCC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC(=C(C=C2)OC)OC.Cl
| PubChem CID | 62969 |
|---|---|
| CAS | 152-11-4 |
| Molecular Weight (g/mol) | 491.07 |
| MDL Number | MFCD00055208 |
| SMILES | CC(C)C(CCCN(C)CCC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC(=C(C=C2)OC)OC.Cl |
| Synonym | verapamil hydrochloride,verapamil hcl,manidon,calcan hydrochloride,cardibeltin,cardiabeltin,cardioprotect,veroptinstada,calaptin,caveril |
| IUPAC Name | 2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-propan-2-ylpentanenitrile;hydrochloride |
| InChI Key | DOQPXTMNIUCOSY-UHFFFAOYSA-N |
| Molecular Formula | C27H38N2O4·HCl |
Resveratrol 99.0+%, TCI America™
CAS: 501-36-0 Molecular Formula: C14H12O3 Molecular Weight (g/mol): 228.247 MDL Number: MFCD00133799 InChI Key: LUKBXSAWLPMMSZ-OWOJBTEDSA-N Synonym: resveratrol,trans-resveratrol,3,4',5-trihydroxystilbene,3,5,4'-trihydroxystilbene,e-resveratrol,3,4',5-stilbenetriol,e-5-4-hydroxystyryl benzene-1,3-diol,resvida,3,4',5-trihydroxy-trans-stilbene,5-e-2-4-hydroxyphenyl ethenyl benzene-1,3-diol PubChem CID: 445154 ChEBI: CHEBI:45713 IUPAC Name: 5-[(E)-2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diol SMILES: C1=CC(=CC=C1C=CC2=CC(=CC(=C2)O)O)O
| PubChem CID | 445154 |
|---|---|
| CAS | 501-36-0 |
| Molecular Weight (g/mol) | 228.247 |
| ChEBI | CHEBI:45713 |
| MDL Number | MFCD00133799 |
| SMILES | C1=CC(=CC=C1C=CC2=CC(=CC(=C2)O)O)O |
| Synonym | resveratrol,trans-resveratrol,3,4',5-trihydroxystilbene,3,5,4'-trihydroxystilbene,e-resveratrol,3,4',5-stilbenetriol,e-5-4-hydroxystyryl benzene-1,3-diol,resvida,3,4',5-trihydroxy-trans-stilbene,5-e-2-4-hydroxyphenyl ethenyl benzene-1,3-diol |
| IUPAC Name | 5-[(E)-2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diol |
| InChI Key | LUKBXSAWLPMMSZ-OWOJBTEDSA-N |
| Molecular Formula | C14H12O3 |
2-Phenylphenol, 99+%
CAS: 90-43-7 Molecular Formula: C12H10O Molecular Weight (g/mol): 170.21 MDL Number: MFCD00002208 InChI Key: LLEMOWNGBBNAJR-UHFFFAOYSA-N Synonym: 2-hydroxybiphenyl,o-phenylphenol,biphenyl-2-ol,2-biphenylol,o-hydroxybiphenyl,2-hydroxydiphenyl,o-hydroxydiphenyl,phenylphenol,biphenylol,1,1'-biphenyl-2-ol PubChem CID: 7017 ChEBI: CHEBI:17043 SMILES: OC1=CC=CC=C1C1=CC=CC=C1
| PubChem CID | 7017 |
|---|---|
| CAS | 90-43-7 |
| Molecular Weight (g/mol) | 170.21 |
| ChEBI | CHEBI:17043 |
| MDL Number | MFCD00002208 |
| SMILES | OC1=CC=CC=C1C1=CC=CC=C1 |
| Synonym | 2-hydroxybiphenyl,o-phenylphenol,biphenyl-2-ol,2-biphenylol,o-hydroxybiphenyl,2-hydroxydiphenyl,o-hydroxydiphenyl,phenylphenol,biphenylol,1,1'-biphenyl-2-ol |
| InChI Key | LLEMOWNGBBNAJR-UHFFFAOYSA-N |
| Molecular Formula | C12H10O |
Carbonyl cyanide 3-chlorophenylhydrazone, 98%
CAS: 555-60-2 Molecular Formula: C9H5ClN4 Molecular Weight (g/mol): 204.617 MDL Number: MFCD00001848 InChI Key: UGTJLJZQQFGTJD-UHFFFAOYSA-N Synonym: cccp,3-chlorophenyl hydrazonomalononitrile,carbonylcyanide-3-chlorophenylhydrazone,carbonyl cyanide 3-chlorophenylhydrazone,carbonyl cyanide m-chlorophenyl hydrazone,carbonyl cyanide m-chlorophenylhydrazone,3-chlorophenyl hydrazono malononitrile,m-chlorophenyl carbonylcyanide hydrazone,m-cl-ccp,carbonyl cyanide, 3-chlorophenyl hydrazone PubChem CID: 2603 ChEBI: CHEBI:3259 IUPAC Name: 2-[(3-chlorophenyl)hydrazinylidene]propanedinitrile SMILES: C1=CC(=CC(=C1)Cl)NN=C(C#N)C#N
| PubChem CID | 2603 |
|---|---|
| CAS | 555-60-2 |
| Molecular Weight (g/mol) | 204.617 |
| ChEBI | CHEBI:3259 |
| MDL Number | MFCD00001848 |
| SMILES | C1=CC(=CC(=C1)Cl)NN=C(C#N)C#N |
| Synonym | cccp,3-chlorophenyl hydrazonomalononitrile,carbonylcyanide-3-chlorophenylhydrazone,carbonyl cyanide 3-chlorophenylhydrazone,carbonyl cyanide m-chlorophenyl hydrazone,carbonyl cyanide m-chlorophenylhydrazone,3-chlorophenyl hydrazono malononitrile,m-chlorophenyl carbonylcyanide hydrazone,m-cl-ccp,carbonyl cyanide, 3-chlorophenyl hydrazone |
| IUPAC Name | 2-[(3-chlorophenyl)hydrazinylidene]propanedinitrile |
| InChI Key | UGTJLJZQQFGTJD-UHFFFAOYSA-N |
| Molecular Formula | C9H5ClN4 |
2-tert-Butylphenol, 99%
CAS: 88-18-6 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 MDL Number: MFCD00002223 InChI Key: WJQOZHYUIDYNHM-UHFFFAOYSA-N Synonym: 2-tert-butyl phenol,2-t-butylphenol,phenol, 2-1,1-dimethylethyl,phenol, o-tert-butyl,o-t-butylphenol,o-tert-butylphenol,tert-butylphenol,2-1,1-dimethylethyl phenol,2-tert-butyl-1-hydroxybenzene,t-butylphenol PubChem CID: 6923 ChEBI: CHEBI:34305 IUPAC Name: 2-tert-butylphenol SMILES: CC(C)(C)C1=CC=CC=C1O
| PubChem CID | 6923 |
|---|---|
| CAS | 88-18-6 |
| Molecular Weight (g/mol) | 150.221 |
| ChEBI | CHEBI:34305 |
| MDL Number | MFCD00002223 |
| SMILES | CC(C)(C)C1=CC=CC=C1O |
| Synonym | 2-tert-butyl phenol,2-t-butylphenol,phenol, 2-1,1-dimethylethyl,phenol, o-tert-butyl,o-t-butylphenol,o-tert-butylphenol,tert-butylphenol,2-1,1-dimethylethyl phenol,2-tert-butyl-1-hydroxybenzene,t-butylphenol |
| IUPAC Name | 2-tert-butylphenol |
| InChI Key | WJQOZHYUIDYNHM-UHFFFAOYSA-N |
| Molecular Formula | C10H14O |
Niclosamide, 97+%, Thermo Scientific Chemicals
CAS: 50-65-7 Molecular Formula: C13H8Cl2N2O4 Molecular Weight (g/mol): 327.12 MDL Number: MFCD00057597 InChI Key: RJMUSRYZPJIFPJ-UHFFFAOYSA-N Synonym: niclosamide,5-chloro-n-2-chloro-4-nitrophenyl-2-hydroxybenzamide,niclocide,bayluscid,phenasal,tredemine,fenasal,yomesan,dichlosale,helmiantin PubChem CID: 4477 IUPAC Name: 5-chloro-N-(2-chloro-4-nitrophenyl)-2-hydroxybenzamide SMILES: OC1=CC=C(Cl)C=C1C(=O)NC1=CC=C(C=C1Cl)[N+]([O-])=O
| PubChem CID | 4477 |
|---|---|
| CAS | 50-65-7 |
| Molecular Weight (g/mol) | 327.12 |
| MDL Number | MFCD00057597 |
| SMILES | OC1=CC=C(Cl)C=C1C(=O)NC1=CC=C(C=C1Cl)[N+]([O-])=O |
| Synonym | niclosamide,5-chloro-n-2-chloro-4-nitrophenyl-2-hydroxybenzamide,niclocide,bayluscid,phenasal,tredemine,fenasal,yomesan,dichlosale,helmiantin |
| IUPAC Name | 5-chloro-N-(2-chloro-4-nitrophenyl)-2-hydroxybenzamide |
| InChI Key | RJMUSRYZPJIFPJ-UHFFFAOYSA-N |
| Molecular Formula | C13H8Cl2N2O4 |
m-Toluidine, 99%
CAS: 108-44-1 Molecular Formula: C7H9N Molecular Weight (g/mol): 107.16 MDL Number: MFCD00007808 InChI Key: JJYPMNFTHPTTDI-UHFFFAOYSA-N Synonym: m-toluidine,3-toluidine,benzenamine, 3-methyl,3-aminotoluene,m-methylaniline,m-tolylamine,m-toluidin,m-aminotoluene,m-methylbenzenamine,3-methylbenzenamine PubChem CID: 7934 IUPAC Name: 3-methylaniline SMILES: CC1=CC=CC(N)=C1
| PubChem CID | 7934 |
|---|---|
| CAS | 108-44-1 |
| Molecular Weight (g/mol) | 107.16 |
| MDL Number | MFCD00007808 |
| SMILES | CC1=CC=CC(N)=C1 |
| Synonym | m-toluidine,3-toluidine,benzenamine, 3-methyl,3-aminotoluene,m-methylaniline,m-tolylamine,m-toluidin,m-aminotoluene,m-methylbenzenamine,3-methylbenzenamine |
| IUPAC Name | 3-methylaniline |
| InChI Key | JJYPMNFTHPTTDI-UHFFFAOYSA-N |
| Molecular Formula | C7H9N |
Styrene, 99.5% stab. with 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 |
o-Tolidine, 98%
CAS: 119-93-7 Molecular Formula: C14H16N2 Molecular Weight (g/mol): 212.296 MDL Number: MFCD00014773 InChI Key: NUIURNJTPRWVAP-UHFFFAOYSA-N Synonym: o-tolidine,3,3'-dimethylbenzidine,orthotolidine,diaminoditolyl,2-tolidine,diaminotolyl,bianisidine,3,3'-tolidine,3,3'-dimethylbiphenyl-4,4'-diamine,4,4'-bi-o-toluidine PubChem CID: 8413 ChEBI: CHEBI:34320 IUPAC Name: 4-(4-amino-3-methylphenyl)-2-methylaniline SMILES: CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)C)N
| PubChem CID | 8413 |
|---|---|
| CAS | 119-93-7 |
| Molecular Weight (g/mol) | 212.296 |
| ChEBI | CHEBI:34320 |
| MDL Number | MFCD00014773 |
| SMILES | CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)C)N |
| Synonym | o-tolidine,3,3'-dimethylbenzidine,orthotolidine,diaminoditolyl,2-tolidine,diaminotolyl,bianisidine,3,3'-tolidine,3,3'-dimethylbiphenyl-4,4'-diamine,4,4'-bi-o-toluidine |
| IUPAC Name | 4-(4-amino-3-methylphenyl)-2-methylaniline |
| InChI Key | NUIURNJTPRWVAP-UHFFFAOYSA-N |
| Molecular Formula | C14H16N2 |