Benzene and substituted derivatives
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2,5-Diethoxyaniline 98.0+%, TCI America™
CAS: 94-85-9 Molecular Formula: C10H15NO2 Molecular Weight (g/mol): 181.235 MDL Number: MFCD00015144 InChI Key: XPKFTIYOZUJAGA-UHFFFAOYSA-N Synonym: benzenamine, 2,5-diethoxy,aminohydroquinone diethyl ether,2,5-diethoxy aniline,aniline, 2,5-diethoxy,2,5-diethoxyphenyl amine,2,5-diethoxyphenylamine,2.5-diethoxyaniline,aniline,5-diethoxy,2,5-diathoxy-anilin,2,5-diethoxybenzenamine PubChem CID: 66756 IUPAC Name: 2,5-diethoxyaniline SMILES: CCOC1=CC(=C(C=C1)OCC)N
| PubChem CID | 66756 |
|---|---|
| CAS | 94-85-9 |
| Molecular Weight (g/mol) | 181.235 |
| MDL Number | MFCD00015144 |
| SMILES | CCOC1=CC(=C(C=C1)OCC)N |
| Synonym | benzenamine, 2,5-diethoxy,aminohydroquinone diethyl ether,2,5-diethoxy aniline,aniline, 2,5-diethoxy,2,5-diethoxyphenyl amine,2,5-diethoxyphenylamine,2.5-diethoxyaniline,aniline,5-diethoxy,2,5-diathoxy-anilin,2,5-diethoxybenzenamine |
| IUPAC Name | 2,5-diethoxyaniline |
| InChI Key | XPKFTIYOZUJAGA-UHFFFAOYSA-N |
| Molecular Formula | C10H15NO2 |
3,5-Dibenzyloxybenzoic Acid 98.0+%, TCI America™
CAS: 28917-43-3 Molecular Formula: C21H18O4 Molecular Weight (g/mol): 334.371 MDL Number: MFCD00191341 InChI Key: DHQIBPUGSWVDOH-UHFFFAOYSA-N Synonym: 3,5-Bis(benzyloxy)benzoic Acid PubChem CID: 99307 IUPAC Name: 3,5-bis(phenylmethoxy)benzoic acid SMILES: C1=CC=C(C=C1)COC2=CC(=CC(=C2)C(=O)O)OCC3=CC=CC=C3
| PubChem CID | 99307 |
|---|---|
| CAS | 28917-43-3 |
| Molecular Weight (g/mol) | 334.371 |
| MDL Number | MFCD00191341 |
| SMILES | C1=CC=C(C=C1)COC2=CC(=CC(=C2)C(=O)O)OCC3=CC=CC=C3 |
| Synonym | 3,5-Bis(benzyloxy)benzoic Acid |
| IUPAC Name | 3,5-bis(phenylmethoxy)benzoic acid |
| InChI Key | DHQIBPUGSWVDOH-UHFFFAOYSA-N |
| Molecular Formula | C21H18O4 |
Phenyl Dichlorophosphate 98.0+%, TCI America™
CAS: 770-12-7 Molecular Formula: C6H5Cl2O2P Molecular Weight (g/mol): 210.978 MDL Number: MFCD00002067 InChI Key: TXFOLHZMICYNRM-UHFFFAOYSA-N Synonym: phenyl dichlorophosphate,phenyl phosphorodichloridate,dichlorophenoxyphosphine oxide,phosphorodichloridic acid, phenyl ester,phenylphosphoric dichloride,phenyl phosphorodichlorodate,phenoxydichlorophosphine oxide,phenyldichlorophosphate,phenoxyphosphoryl dichloride,phosphoroyl dichloride phenyl ester PubChem CID: 13038 IUPAC Name: dichlorophosphoryloxybenzene SMILES: C1=CC=C(C=C1)OP(=O)(Cl)Cl
| PubChem CID | 13038 |
|---|---|
| CAS | 770-12-7 |
| Molecular Weight (g/mol) | 210.978 |
| MDL Number | MFCD00002067 |
| SMILES | C1=CC=C(C=C1)OP(=O)(Cl)Cl |
| Synonym | phenyl dichlorophosphate,phenyl phosphorodichloridate,dichlorophenoxyphosphine oxide,phosphorodichloridic acid, phenyl ester,phenylphosphoric dichloride,phenyl phosphorodichlorodate,phenoxydichlorophosphine oxide,phenyldichlorophosphate,phenoxyphosphoryl dichloride,phosphoroyl dichloride phenyl ester |
| IUPAC Name | dichlorophosphoryloxybenzene |
| InChI Key | TXFOLHZMICYNRM-UHFFFAOYSA-N |
| Molecular Formula | C6H5Cl2O2P |
Phenetole 98.0+%, TCI America™
CAS: 103-73-1 Molecular Formula: C8H10O Molecular Weight (g/mol): 122.167 MDL Number: MFCD00009090 InChI Key: DLRJIFUOBPOJNS-UHFFFAOYSA-N Synonym: phenetole,benzene, ethoxy,ethyl phenyl ether,phenetol,phenyl ethyl ether,phenoxyethane,a phenoxyethane,ether, ethyl phenyl,unii-rb8lu2c57f PubChem CID: 7674 ChEBI: CHEBI:67129 IUPAC Name: ethoxybenzene SMILES: CCOC1=CC=CC=C1
| PubChem CID | 7674 |
|---|---|
| CAS | 103-73-1 |
| Molecular Weight (g/mol) | 122.167 |
| ChEBI | CHEBI:67129 |
| MDL Number | MFCD00009090 |
| SMILES | CCOC1=CC=CC=C1 |
| Synonym | phenetole,benzene, ethoxy,ethyl phenyl ether,phenetol,phenyl ethyl ether,phenoxyethane,a phenoxyethane,ether, ethyl phenyl,unii-rb8lu2c57f |
| IUPAC Name | ethoxybenzene |
| InChI Key | DLRJIFUOBPOJNS-UHFFFAOYSA-N |
| Molecular Formula | C8H10O |
4-Ethylphenetole 97.0+%, TCI America™
CAS: 1585-06-4 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 MDL Number: MFCD00191432 InChI Key: BQBROHBMIBOPFU-UHFFFAOYSA-N Synonym: 1-Ethoxy-4-ethylbenzene PubChem CID: 74107 IUPAC Name: 1-ethoxy-4-ethylbenzene SMILES: CCC1=CC=C(C=C1)OCC
| PubChem CID | 74107 |
|---|---|
| CAS | 1585-06-4 |
| Molecular Weight (g/mol) | 150.221 |
| MDL Number | MFCD00191432 |
| SMILES | CCC1=CC=C(C=C1)OCC |
| Synonym | 1-Ethoxy-4-ethylbenzene |
| IUPAC Name | 1-ethoxy-4-ethylbenzene |
| InChI Key | BQBROHBMIBOPFU-UHFFFAOYSA-N |
| Molecular Formula | C10H14O |
Ethylene Glycol Diphenyl Ether 99.0+%, TCI America™
CAS: 104-66-5 Molecular Formula: C14H14O2 Molecular Weight (g/mol): 214.26 MDL Number: MFCD00003039 InChI Key: XCSGHNKDXGYELG-UHFFFAOYSA-N Synonym: 1,2-diphenoxyethane,ethylene glycol diphenyl ether,diphenyl glycol,ethane, 1,2-diphenoxy,benzene, 1,1'-1,2-ethanediylbis oxy bis,2-phenoxyethyl phenyl ether,unii-v9w31hx4aw,diphenyl cellosolve,1,1'-ethane-1,2-diylbis oxy dibenzene,2-phenoxyethoxy benzene PubChem CID: 7713 IUPAC Name: (2-phenoxyethoxy)benzene SMILES: C(COC1=CC=CC=C1)OC1=CC=CC=C1
| PubChem CID | 7713 |
|---|---|
| CAS | 104-66-5 |
| Molecular Weight (g/mol) | 214.26 |
| MDL Number | MFCD00003039 |
| SMILES | C(COC1=CC=CC=C1)OC1=CC=CC=C1 |
| Synonym | 1,2-diphenoxyethane,ethylene glycol diphenyl ether,diphenyl glycol,ethane, 1,2-diphenoxy,benzene, 1,1'-1,2-ethanediylbis oxy bis,2-phenoxyethyl phenyl ether,unii-v9w31hx4aw,diphenyl cellosolve,1,1'-ethane-1,2-diylbis oxy dibenzene,2-phenoxyethoxy benzene |
| IUPAC Name | (2-phenoxyethoxy)benzene |
| InChI Key | XCSGHNKDXGYELG-UHFFFAOYSA-N |
| Molecular Formula | C14H14O2 |
2-Methyl-6-(trimethylsilyl)phenyl Trifluoromethanesulfonate 96.0+%, TCI America™
CAS: 556812-44-3 Molecular Formula: C11H15F3O3SSi Molecular Weight (g/mol): 312.38 MDL Number: MFCD10566915 InChI Key: ZCWWZFXNICWDIB-UHFFFAOYSA-N Synonym: 2-Methyl-6-(trimethylsilyl)phenyl Triflate, Trifluoromethanesulfonic Acid 2-Methyl-6-(trimethylsilyl)phenyl Ester, 6-(Trimethylsilyl)-o-tolyl Trifluoromethanesulfonate PubChem CID: 12182646 IUPAC Name: 2-methyl-6-(trimethylsilyl)phenyl trifluoromethanesulfonate SMILES: CC1=C(OS(=O)(=O)C(F)(F)F)C(=CC=C1)[Si](C)(C)C
| PubChem CID | 12182646 |
|---|---|
| CAS | 556812-44-3 |
| Molecular Weight (g/mol) | 312.38 |
| MDL Number | MFCD10566915 |
| SMILES | CC1=C(OS(=O)(=O)C(F)(F)F)C(=CC=C1)[Si](C)(C)C |
| Synonym | 2-Methyl-6-(trimethylsilyl)phenyl Triflate, Trifluoromethanesulfonic Acid 2-Methyl-6-(trimethylsilyl)phenyl Ester, 6-(Trimethylsilyl)-o-tolyl Trifluoromethanesulfonate |
| IUPAC Name | 2-methyl-6-(trimethylsilyl)phenyl trifluoromethanesulfonate |
| InChI Key | ZCWWZFXNICWDIB-UHFFFAOYSA-N |
| Molecular Formula | C11H15F3O3SSi |
1,3-Dibenzyloxybenzene 96.0+%, TCI America™
CAS: 3769-42-4 Molecular Formula: C20H18O2 Molecular Weight (g/mol): 290.36 MDL Number: MFCD00690156 InChI Key: RESHZVQZWMQUMB-UHFFFAOYSA-N Synonym: 1,3-Bis(benzyloxy)benzene, Resorcinol Dibenzyl Ether PubChem CID: 1363616 IUPAC Name: 1,3-bis(benzyloxy)benzene SMILES: C(OC1=CC(OCC2=CC=CC=C2)=CC=C1)C1=CC=CC=C1
| PubChem CID | 1363616 |
|---|---|
| CAS | 3769-42-4 |
| Molecular Weight (g/mol) | 290.36 |
| MDL Number | MFCD00690156 |
| SMILES | C(OC1=CC(OCC2=CC=CC=C2)=CC=C1)C1=CC=CC=C1 |
| Synonym | 1,3-Bis(benzyloxy)benzene, Resorcinol Dibenzyl Ether |
| IUPAC Name | 1,3-bis(benzyloxy)benzene |
| InChI Key | RESHZVQZWMQUMB-UHFFFAOYSA-N |
| Molecular Formula | C20H18O2 |
Bis(2,6-dimethylphenyl) Chlorophosphate 93.0+%, TCI America™
CAS: 81639-99-8 Molecular Formula: C16H18ClO3P Molecular Weight (g/mol): 324.741 MDL Number: MFCD00623313 InChI Key: WXCXJSOCIOHPLT-UHFFFAOYSA-N Synonym: Bis(2,6-dimethylphenyl)phosphoryl Chloride, Chlorophosphoric Acid Bis(2,6-dimethylphenyl) Ester PubChem CID: 9923313 IUPAC Name: 2-[chloro-(2,6-dimethylphenoxy)phosphoryl]oxy-1,3-dimethylbenzene SMILES: CC1=C(C(=CC=C1)C)OP(=O)(OC2=C(C=CC=C2C)C)Cl
| PubChem CID | 9923313 |
|---|---|
| CAS | 81639-99-8 |
| Molecular Weight (g/mol) | 324.741 |
| MDL Number | MFCD00623313 |
| SMILES | CC1=C(C(=CC=C1)C)OP(=O)(OC2=C(C=CC=C2C)C)Cl |
| Synonym | Bis(2,6-dimethylphenyl)phosphoryl Chloride, Chlorophosphoric Acid Bis(2,6-dimethylphenyl) Ester |
| IUPAC Name | 2-[chloro-(2,6-dimethylphenoxy)phosphoryl]oxy-1,3-dimethylbenzene |
| InChI Key | WXCXJSOCIOHPLT-UHFFFAOYSA-N |
| Molecular Formula | C16H18ClO3P |
4-Ethoxybenzoic Acid 98.0+%, TCI America™
CAS: 619-86-3 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00002545 InChI Key: SHSGDXCJYVZFTP-UHFFFAOYSA-N Synonym: p-ethoxybenzoic acid,benzoic acid, 4-ethoxy,benzoic acid, p-ethoxy,4-ethoxy-benzoic acid,unii-tzr23xeq7w,tzr23xeq7w,4-ethoxybenzoicacid,4ethoxybenzoic acid,pubchem2686,para-ethoxybenzoic acid PubChem CID: 12093 IUPAC Name: 4-ethoxybenzoic acid SMILES: CCOC1=CC=C(C=C1)C(=O)O
| PubChem CID | 12093 |
|---|---|
| CAS | 619-86-3 |
| Molecular Weight (g/mol) | 166.176 |
| MDL Number | MFCD00002545 |
| SMILES | CCOC1=CC=C(C=C1)C(=O)O |
| Synonym | p-ethoxybenzoic acid,benzoic acid, 4-ethoxy,benzoic acid, p-ethoxy,4-ethoxy-benzoic acid,unii-tzr23xeq7w,tzr23xeq7w,4-ethoxybenzoicacid,4ethoxybenzoic acid,pubchem2686,para-ethoxybenzoic acid |
| IUPAC Name | 4-ethoxybenzoic acid |
| InChI Key | SHSGDXCJYVZFTP-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
Diphenyl N-Cyanocarbonimidate 97.0+%, TCI America™
CAS: 79463-77-7 Molecular Formula: C14H10N2O2 Molecular Weight (g/mol): 238.25 MDL Number: MFCD00010380 InChI Key: SLIKWVTWIGHFJE-UHFFFAOYSA-N Synonym: diphenyl n-cyanocarbonimidate,diphenyl cyanocarbonimidate,diphenoxymethylenecyanamide,n-cyano-diphenyl imidocarbonate,diphenylcyanocarbonimidate,cyanocarbonimidia acid diphenyl aester,n-cyanocarbonimidic acid diphenyl ester,bis phenoxy methylidenecyanamide,cyano diphenoxymethylidene amine,3,3-diphenoxy-2-azaprop-2-enenitrile PubChem CID: 688090 IUPAC Name: cyano(diphenoxymethylidene)amine SMILES: N#CN=C(OC1=CC=CC=C1)OC1=CC=CC=C1
| PubChem CID | 688090 |
|---|---|
| CAS | 79463-77-7 |
| Molecular Weight (g/mol) | 238.25 |
| MDL Number | MFCD00010380 |
| SMILES | N#CN=C(OC1=CC=CC=C1)OC1=CC=CC=C1 |
| Synonym | diphenyl n-cyanocarbonimidate,diphenyl cyanocarbonimidate,diphenoxymethylenecyanamide,n-cyano-diphenyl imidocarbonate,diphenylcyanocarbonimidate,cyanocarbonimidia acid diphenyl aester,n-cyanocarbonimidic acid diphenyl ester,bis phenoxy methylidenecyanamide,cyano diphenoxymethylidene amine,3,3-diphenoxy-2-azaprop-2-enenitrile |
| IUPAC Name | cyano(diphenoxymethylidene)amine |
| InChI Key | SLIKWVTWIGHFJE-UHFFFAOYSA-N |
| Molecular Formula | C14H10N2O2 |
Ethylene Glycol Di(m-tolyl) Ether 97.0+%, TCI America™
CAS: 54914-85-1 Molecular Formula: C16H18O2 Molecular Weight (g/mol): 242.32 MDL Number: MFCD00025952 InChI Key: OAGNKYSIOSDNIG-UHFFFAOYSA-N Synonym: 1,1′-[1,2-Ethanediylbis(oxy)]bis(3-methylbenzene), 1,2-Bis(3-methylphenoxy)ethane PubChem CID: 97354 IUPAC Name: 1-methyl-3-[2-(3-methylphenoxy)ethoxy]benzene SMILES: CC1=CC(OCCOC2=CC(C)=CC=C2)=CC=C1
| PubChem CID | 97354 |
|---|---|
| CAS | 54914-85-1 |
| Molecular Weight (g/mol) | 242.32 |
| MDL Number | MFCD00025952 |
| SMILES | CC1=CC(OCCOC2=CC(C)=CC=C2)=CC=C1 |
| Synonym | 1,1′-[1,2-Ethanediylbis(oxy)]bis(3-methylbenzene), 1,2-Bis(3-methylphenoxy)ethane |
| IUPAC Name | 1-methyl-3-[2-(3-methylphenoxy)ethoxy]benzene |
| InChI Key | OAGNKYSIOSDNIG-UHFFFAOYSA-N |
| Molecular Formula | C16H18O2 |
Rivastigmine L-Tartrate 98.0+%, TCI America™
CAS: 129101-54-8 Molecular Formula: C18H28N2O8 Molecular Weight (g/mol): 400.43 MDL Number: MFCD03700731 InChI Key: GWHQHAUAXRMMOT-RWALOXMOSA-N Synonym: rivastigmine tartrate,rivastigmine bitartrate,sdz-ena 713,rivastigmine hydrogen tartrate,rivastigmine hydrogentartrate,unii-9iy2357jpe,s-3-1-dimethylamino ethyl phenyl ethyl methyl carbamate 2r,3r-2,3-dihydroxysuccinate,rivastigmine tartrate exelon,carbamic acid, ethylmethyl-, 3-1s-1-dimethylamino ethyl phenyl ester, 2r,3r-2,3-dihydroxybutanedioate 1:1 PubChem CID: 6918078 ChEBI: CHEBI:64358 IUPAC Name: (2S,3S)-2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate SMILES: O[C@@H]([C@H](O)C(O)=O)C(O)=O.CCN(C)C(=O)OC1=CC=CC(=C1)[C@H](C)N(C)C
| PubChem CID | 6918078 |
|---|---|
| CAS | 129101-54-8 |
| Molecular Weight (g/mol) | 400.43 |
| ChEBI | CHEBI:64358 |
| MDL Number | MFCD03700731 |
| SMILES | O[C@@H]([C@H](O)C(O)=O)C(O)=O.CCN(C)C(=O)OC1=CC=CC(=C1)[C@H](C)N(C)C |
| Synonym | rivastigmine tartrate,rivastigmine bitartrate,sdz-ena 713,rivastigmine hydrogen tartrate,rivastigmine hydrogentartrate,unii-9iy2357jpe,s-3-1-dimethylamino ethyl phenyl ethyl methyl carbamate 2r,3r-2,3-dihydroxysuccinate,rivastigmine tartrate exelon,carbamic acid, ethylmethyl-, 3-1s-1-dimethylamino ethyl phenyl ester, 2r,3r-2,3-dihydroxybutanedioate 1:1 |
| IUPAC Name | (2S,3S)-2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate |
| InChI Key | GWHQHAUAXRMMOT-RWALOXMOSA-N |
| Molecular Formula | C18H28N2O8 |
2-Propoxybenzoic Acid 98.0+%, TCI America™
CAS: 2100-31-4 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD01075687 InChI Key: OXOWWPXTTOCKKU-UHFFFAOYSA-N Synonym: 2-n-propoxybenzoic acid,o-propoxybenzoic acid,benzoic acid, 2-propoxy,2-propoxy benzoic acid,salicylic acid propyl ether,akos bbb/270,rarechem al bo 0876,propyloxybenzoic acid,2-propoxybenzoic acid,o-propoxy benzoic acid PubChem CID: 539215 IUPAC Name: 2-propoxybenzoic acid SMILES: CCCOC1=CC=CC=C1C(=O)O
| PubChem CID | 539215 |
|---|---|
| CAS | 2100-31-4 |
| Molecular Weight (g/mol) | 180.203 |
| MDL Number | MFCD01075687 |
| SMILES | CCCOC1=CC=CC=C1C(=O)O |
| Synonym | 2-n-propoxybenzoic acid,o-propoxybenzoic acid,benzoic acid, 2-propoxy,2-propoxy benzoic acid,salicylic acid propyl ether,akos bbb/270,rarechem al bo 0876,propyloxybenzoic acid,2-propoxybenzoic acid,o-propoxy benzoic acid |
| IUPAC Name | 2-propoxybenzoic acid |
| InChI Key | OXOWWPXTTOCKKU-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
3,4-Dimethoxybenzonitrile 98.0+%, TCI America™
CAS: 2024-83-1 Molecular Formula: C9H9NO2 Molecular Weight (g/mol): 163.18 MDL Number: MFCD00001802 InChI Key: OSEQIDSFSBWXRE-UHFFFAOYSA-N Synonym: veratronitrile,4-cyanoveratrole,3,4-dimethoxy-benzonitrile,4-cyano-1,2-dimethoxybenzene,1-cyano-3,4-dimethoxylbenzene,3,4-dimethoxybenzoic acid nitrile,3,4-dimethoxyphenyl cyanide,benzonitrile,4-dimethoxy,3,4-dimethoxybenzenecarbonitrile,3-cyanoveratrole PubChem CID: 74842 IUPAC Name: 3,4-dimethoxybenzonitrile SMILES: COC1=CC=C(C=C1OC)C#N
| PubChem CID | 74842 |
|---|---|
| CAS | 2024-83-1 |
| Molecular Weight (g/mol) | 163.18 |
| MDL Number | MFCD00001802 |
| SMILES | COC1=CC=C(C=C1OC)C#N |
| Synonym | veratronitrile,4-cyanoveratrole,3,4-dimethoxy-benzonitrile,4-cyano-1,2-dimethoxybenzene,1-cyano-3,4-dimethoxylbenzene,3,4-dimethoxybenzoic acid nitrile,3,4-dimethoxyphenyl cyanide,benzonitrile,4-dimethoxy,3,4-dimethoxybenzenecarbonitrile,3-cyanoveratrole |
| IUPAC Name | 3,4-dimethoxybenzonitrile |
| InChI Key | OSEQIDSFSBWXRE-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO2 |