Benzene and substituted derivatives
Filtered Search Results
4-Fluorophenyl Isocyanate 98.0+%, TCI America™
CAS: 1195-45-5 Molecular Formula: C7H4FNO Molecular Weight (g/mol): 137.113 MDL Number: MFCD00002023 InChI Key: DSVGFKBFFICWLZ-UHFFFAOYSA-N PubChem CID: 70955 IUPAC Name: 1-fluoro-4-isocyanatobenzene SMILES: C1=CC(=CC=C1N=C=O)F
| PubChem CID | 70955 |
|---|---|
| CAS | 1195-45-5 |
| Molecular Weight (g/mol) | 137.113 |
| MDL Number | MFCD00002023 |
| SMILES | C1=CC(=CC=C1N=C=O)F |
| IUPAC Name | 1-fluoro-4-isocyanatobenzene |
| InChI Key | DSVGFKBFFICWLZ-UHFFFAOYSA-N |
| Molecular Formula | C7H4FNO |
Ethyl 4-Iodobenzoate 98.0+%, TCI America™
CAS: 51934-41-9 Molecular Formula: C9H9IO2 Molecular Weight (g/mol): 276.07 MDL Number: MFCD00017344 InChI Key: YCBJOQUNPLTBGG-UHFFFAOYSA-N Synonym: p-iodobenzoic acid ethyl ester,4-iodobenzoic acid ethyl ester,ethyl p-iodobenzoate,ethyl-4-iodobenzoate,benzoicacid,4-iodo-,ethylester,4-iodo-benzoic acid ethyl ester,benzoic acid, 4-iodo-, ethyl ester,ethyl4-iodobenzoate,ethyl-4 iodobenzoate,ethyl,4-iodobenzoate PubChem CID: 142891 IUPAC Name: ethyl 4-iodobenzoate SMILES: CCOC(=O)C1=CC=C(I)C=C1
| PubChem CID | 142891 |
|---|---|
| CAS | 51934-41-9 |
| Molecular Weight (g/mol) | 276.07 |
| MDL Number | MFCD00017344 |
| SMILES | CCOC(=O)C1=CC=C(I)C=C1 |
| Synonym | p-iodobenzoic acid ethyl ester,4-iodobenzoic acid ethyl ester,ethyl p-iodobenzoate,ethyl-4-iodobenzoate,benzoicacid,4-iodo-,ethylester,4-iodo-benzoic acid ethyl ester,benzoic acid, 4-iodo-, ethyl ester,ethyl4-iodobenzoate,ethyl-4 iodobenzoate,ethyl,4-iodobenzoate |
| IUPAC Name | ethyl 4-iodobenzoate |
| InChI Key | YCBJOQUNPLTBGG-UHFFFAOYSA-N |
| Molecular Formula | C9H9IO2 |
Disodium Terephthalate 99.0+%, TCI America™
CAS: 10028-70-3 Molecular Formula: C8H4Na2O4 Molecular Weight (g/mol): 210.096 MDL Number: MFCD00013137 InChI Key: VIQSRHWJEKERKR-UHFFFAOYSA-L Synonym: disodium terephthalate,terephthalic acid disodium salt,terephthalic acid, disodium salt,sodium terephthalate,unii-gi30zoc0oo,gi30zoc0oo,disodiumterephthalate,acmc-1bvw0,disodium terephthalate 5g,1,4-benzenedicarboxylicacid, sodium salt 1:? PubChem CID: 82305 IUPAC Name: disodium;terephthalate SMILES: C1=CC(=CC=C1C(=O)[O-])C(=O)[O-].[Na+].[Na+]
| PubChem CID | 82305 |
|---|---|
| CAS | 10028-70-3 |
| Molecular Weight (g/mol) | 210.096 |
| MDL Number | MFCD00013137 |
| SMILES | C1=CC(=CC=C1C(=O)[O-])C(=O)[O-].[Na+].[Na+] |
| Synonym | disodium terephthalate,terephthalic acid disodium salt,terephthalic acid, disodium salt,sodium terephthalate,unii-gi30zoc0oo,gi30zoc0oo,disodiumterephthalate,acmc-1bvw0,disodium terephthalate 5g,1,4-benzenedicarboxylicacid, sodium salt 1:? |
| IUPAC Name | disodium;terephthalate |
| InChI Key | VIQSRHWJEKERKR-UHFFFAOYSA-L |
| Molecular Formula | C8H4Na2O4 |
p-Toluenesulfonylmethyl Isocyanide 98.0+%, TCI America™
CAS: 36635-61-7 Molecular Formula: C9H9NO2S Molecular Weight (g/mol): 195.24 MDL Number: MFCD00000005 InChI Key: CFOAUYCPAUGDFF-UHFFFAOYSA-N Synonym: tosylmethyl isocyanide,tosmic,p-toluenesulfonylmethyl isocyanide,4-toluenesulphonylmethyl isocyanide,4-toluenesulfonylmethyl isocyanide,tosylmethylisocyanide,1-isocyanomethylsulfonyl-4-methylbenzene,p-tolylsulfonyl methyl isocyanide,unii-c35fd6olh8,1-isocyanomethyl sulfonyl-4-methylbenzene PubChem CID: 161915 IUPAC Name: 1-isocyanomethanesulfonyl-4-methylbenzene SMILES: CC1=CC=C(C=C1)S(=O)(=O)C[N+]#[C-]
| PubChem CID | 161915 |
|---|---|
| CAS | 36635-61-7 |
| Molecular Weight (g/mol) | 195.24 |
| MDL Number | MFCD00000005 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C[N+]#[C-] |
| Synonym | tosylmethyl isocyanide,tosmic,p-toluenesulfonylmethyl isocyanide,4-toluenesulphonylmethyl isocyanide,4-toluenesulfonylmethyl isocyanide,tosylmethylisocyanide,1-isocyanomethylsulfonyl-4-methylbenzene,p-tolylsulfonyl methyl isocyanide,unii-c35fd6olh8,1-isocyanomethyl sulfonyl-4-methylbenzene |
| IUPAC Name | 1-isocyanomethanesulfonyl-4-methylbenzene |
| InChI Key | CFOAUYCPAUGDFF-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO2S |
4-(Trifluoromethoxy)aniline 98.0+%, TCI America™
CAS: 461-82-5 Molecular Formula: C7H6F3NO Molecular Weight (g/mol): 177.126 MDL Number: MFCD00041314 InChI Key: XUJFOSLZQITUOI-UHFFFAOYSA-N Synonym: 4-trifluoromethoxy aniline,4-trifluoromethoxy-phenylamine,4-trifluoromethoxy benzenamine,p-trifluoromethoxyaniline,4-trifluoroethoxy aniline,benzenamine, 4-trifluoromethoxy,unii-p40l42cvf6,alpha,alpha,alpha-trifluoro-p-anisidine,p-aminotrifluoromethoxybenzene,4-amino-alpha,alpha,alpha-trifluoroanisole PubChem CID: 600848 IUPAC Name: 4-(trifluoromethoxy)aniline SMILES: C1=CC(=CC=C1N)OC(F)(F)F
| PubChem CID | 600848 |
|---|---|
| CAS | 461-82-5 |
| Molecular Weight (g/mol) | 177.126 |
| MDL Number | MFCD00041314 |
| SMILES | C1=CC(=CC=C1N)OC(F)(F)F |
| Synonym | 4-trifluoromethoxy aniline,4-trifluoromethoxy-phenylamine,4-trifluoromethoxy benzenamine,p-trifluoromethoxyaniline,4-trifluoroethoxy aniline,benzenamine, 4-trifluoromethoxy,unii-p40l42cvf6,alpha,alpha,alpha-trifluoro-p-anisidine,p-aminotrifluoromethoxybenzene,4-amino-alpha,alpha,alpha-trifluoroanisole |
| IUPAC Name | 4-(trifluoromethoxy)aniline |
| InChI Key | XUJFOSLZQITUOI-UHFFFAOYSA-N |
| Molecular Formula | C7H6F3NO |
2,4,5-Trimethylbenzaldehyde 97.0+%, TCI America™
CAS: 5779-72-6 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.21 MDL Number: MFCD00017713 InChI Key: LROJZZICACKNJL-UHFFFAOYSA-N PubChem CID: 22013 IUPAC Name: 2,4,5-trimethylbenzaldehyde SMILES: CC1=CC(C)=C(C=O)C=C1C
| PubChem CID | 22013 |
|---|---|
| CAS | 5779-72-6 |
| Molecular Weight (g/mol) | 148.21 |
| MDL Number | MFCD00017713 |
| SMILES | CC1=CC(C)=C(C=O)C=C1C |
| IUPAC Name | 2,4,5-trimethylbenzaldehyde |
| InChI Key | LROJZZICACKNJL-UHFFFAOYSA-N |
| Molecular Formula | C10H12O |
3,4,5,6-Tetrafluorosalicylic Acid 98.0+%, TCI America™
CAS: 14742-36-0 Molecular Formula: C7H2F4O3 Molecular Weight (g/mol): 210.08 MDL Number: MFCD00483242 InChI Key: WKYGDMSOKGXAAY-UHFFFAOYSA-N Synonym: 3,4,5,6-Tetrafluoro-2-hydroxybenzoic Acid PubChem CID: 11020133 IUPAC Name: 2,3,4,5-tetrafluoro-6-hydroxybenzoic acid SMILES: OC(=O)C1=C(O)C(F)=C(F)C(F)=C1F
| PubChem CID | 11020133 |
|---|---|
| CAS | 14742-36-0 |
| Molecular Weight (g/mol) | 210.08 |
| MDL Number | MFCD00483242 |
| SMILES | OC(=O)C1=C(O)C(F)=C(F)C(F)=C1F |
| Synonym | 3,4,5,6-Tetrafluoro-2-hydroxybenzoic Acid |
| IUPAC Name | 2,3,4,5-tetrafluoro-6-hydroxybenzoic acid |
| InChI Key | WKYGDMSOKGXAAY-UHFFFAOYSA-N |
| Molecular Formula | C7H2F4O3 |
2,4,6-Trifluorobenzonitrile 98.0+%, TCI America™
CAS: 96606-37-0 Molecular Formula: C7H2F3N Molecular Weight (g/mol): 157.095 MDL Number: MFCD00042399 InChI Key: HTKFGTCCOJIUIK-UHFFFAOYSA-N Synonym: benzonitrile, 2,4,6-trifluoro,2,4,6-trifluorobenzenecarbonitrile,ncr bf df ff,pubchem1565,acmc-209s7e,ksc488g9f,2,4,6-trifluoro-benzonitrile,2,4,6-trifluorobenzonitrile,benzonitrile, 2,4,6-trifluoro-, radical ion 1-9ci PubChem CID: 737177 IUPAC Name: 2,4,6-trifluorobenzonitrile SMILES: C1=C(C=C(C(=C1F)C#N)F)F
| PubChem CID | 737177 |
|---|---|
| CAS | 96606-37-0 |
| Molecular Weight (g/mol) | 157.095 |
| MDL Number | MFCD00042399 |
| SMILES | C1=C(C=C(C(=C1F)C#N)F)F |
| Synonym | benzonitrile, 2,4,6-trifluoro,2,4,6-trifluorobenzenecarbonitrile,ncr bf df ff,pubchem1565,acmc-209s7e,ksc488g9f,2,4,6-trifluoro-benzonitrile,2,4,6-trifluorobenzonitrile,benzonitrile, 2,4,6-trifluoro-, radical ion 1-9ci |
| IUPAC Name | 2,4,6-trifluorobenzonitrile |
| InChI Key | HTKFGTCCOJIUIK-UHFFFAOYSA-N |
| Molecular Formula | C7H2F3N |
Tri-O-benzyl-D-glucal 95.0+%, TCI America™
CAS: 55628-54-1 Molecular Formula: C27H28O4 Molecular Weight (g/mol): 416.517 MDL Number: MFCD00061640 InChI Key: MXYLLYBWXIUMIT-PFBJBMPXSA-N Synonym: 3,4,6-tri-o-benzyl-d-glucal,tri-o-benzyl-d-glucal,2r,3s,4r-3,4-bis benzyloxy-2-benzyloxy methyl-3,4-dihydro-2h-pyran,pubchem10548,1,5-anhydro-3,4,6-tri-o-benzyl-2-deoxy-d-arabinohex-1-enitol,1,5-anhydro-2-deoxy-d-arabino-hex-1-enitol 3,4,6-tribenzyl ether PubChem CID: 11742644 IUPAC Name: (2R,3S,4R)-3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran SMILES: C1=CC=C(C=C1)COCC2C(C(C=CO2)OCC3=CC=CC=C3)OCC4=CC=CC=C4
| PubChem CID | 11742644 |
|---|---|
| CAS | 55628-54-1 |
| Molecular Weight (g/mol) | 416.517 |
| MDL Number | MFCD00061640 |
| SMILES | C1=CC=C(C=C1)COCC2C(C(C=CO2)OCC3=CC=CC=C3)OCC4=CC=CC=C4 |
| Synonym | 3,4,6-tri-o-benzyl-d-glucal,tri-o-benzyl-d-glucal,2r,3s,4r-3,4-bis benzyloxy-2-benzyloxy methyl-3,4-dihydro-2h-pyran,pubchem10548,1,5-anhydro-3,4,6-tri-o-benzyl-2-deoxy-d-arabinohex-1-enitol,1,5-anhydro-2-deoxy-d-arabino-hex-1-enitol 3,4,6-tribenzyl ether |
| IUPAC Name | (2R,3S,4R)-3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran |
| InChI Key | MXYLLYBWXIUMIT-PFBJBMPXSA-N |
| Molecular Formula | C27H28O4 |
2,3,6-Trimethoxybenzoic Acid 98.0+%, TCI America™
CAS: 60241-74-9 Molecular Formula: C10H12O5 Molecular Weight (g/mol): 212.201 MDL Number: MFCD00092587 InChI Key: NSKSXYUOXAQHCH-UHFFFAOYSA-N PubChem CID: 611400 IUPAC Name: 2,3,6-trimethoxybenzoic acid SMILES: COC1=C(C(=C(C=C1)OC)OC)C(=O)O
| PubChem CID | 611400 |
|---|---|
| CAS | 60241-74-9 |
| Molecular Weight (g/mol) | 212.201 |
| MDL Number | MFCD00092587 |
| SMILES | COC1=C(C(=C(C=C1)OC)OC)C(=O)O |
| IUPAC Name | 2,3,6-trimethoxybenzoic acid |
| InChI Key | NSKSXYUOXAQHCH-UHFFFAOYSA-N |
| Molecular Formula | C10H12O5 |
Monosodium 2-Sulfoterephthalate 98.0+%, TCI America™
CAS: 19089-60-2 Molecular Formula: C8H5NaO7S Molecular Weight (g/mol): 268.171 MDL Number: MFCD00059843 InChI Key: JARIJYUQOKFVAJ-UHFFFAOYSA-M Synonym: 2-Sulfoterephthalic Acid Monosodium Salt PubChem CID: 44630481 IUPAC Name: sodium;4-carboxy-2-sulfobenzoate SMILES: C1=CC(=C(C=C1C(=O)O)S(=O)(=O)O)C(=O)[O-].[Na+]
| PubChem CID | 44630481 |
|---|---|
| CAS | 19089-60-2 |
| Molecular Weight (g/mol) | 268.171 |
| MDL Number | MFCD00059843 |
| SMILES | C1=CC(=C(C=C1C(=O)O)S(=O)(=O)O)C(=O)[O-].[Na+] |
| Synonym | 2-Sulfoterephthalic Acid Monosodium Salt |
| IUPAC Name | sodium;4-carboxy-2-sulfobenzoate |
| InChI Key | JARIJYUQOKFVAJ-UHFFFAOYSA-M |
| Molecular Formula | C8H5NaO7S |
2-Fluoro-6-methoxybenzonitrile 98.0+%, TCI America™
CAS: 94088-46-7 Molecular Formula: C8H6FNO Molecular Weight (g/mol): 151.14 MDL Number: MFCD00042291 InChI Key: YPMSIWYNTPSPMV-UHFFFAOYSA-N Synonym: 2-cyano-3-fluoroanisole,benzonitrile, 2-fluoro-6-methoxy,6-fluoro-o-anisonitrile,2-fluoro-6-methoxybenzenecarbonitrile,buttpark 45\03-64,pubchem10117,acmc-209rov,ksc494m1p,2-fluoro-6-methoxycyanobenzene PubChem CID: 523101 IUPAC Name: 2-fluoro-6-methoxybenzonitrile SMILES: COC1=C(C(=CC=C1)F)C#N
| PubChem CID | 523101 |
|---|---|
| CAS | 94088-46-7 |
| Molecular Weight (g/mol) | 151.14 |
| MDL Number | MFCD00042291 |
| SMILES | COC1=C(C(=CC=C1)F)C#N |
| Synonym | 2-cyano-3-fluoroanisole,benzonitrile, 2-fluoro-6-methoxy,6-fluoro-o-anisonitrile,2-fluoro-6-methoxybenzenecarbonitrile,buttpark 45\03-64,pubchem10117,acmc-209rov,ksc494m1p,2-fluoro-6-methoxycyanobenzene |
| IUPAC Name | 2-fluoro-6-methoxybenzonitrile |
| InChI Key | YPMSIWYNTPSPMV-UHFFFAOYSA-N |
| Molecular Formula | C8H6FNO |
3-Nitrobenzyl Alcohol 99.0+%, TCI America™
CAS: 619-25-0 Molecular Formula: C7H7NO3 Molecular Weight (g/mol): 153.137 MDL Number: MFCD00007273 InChI Key: CWNPOQFCIIFQDM-UHFFFAOYSA-N Synonym: 3-nitrobenzyl alcohol,3-nitrophenyl methanol,m-nitrobenzyl alcohol,benzenemethanol, 3-nitro,benzyl alcohol, m-nitro,3-nitrobenzenemethanol,unii-f829x990iv,ccris 7971,3-nitrophenyl methan-1-ol,3-nitrobenzylalcohol PubChem CID: 69267 IUPAC Name: (3-nitrophenyl)methanol SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])CO
| PubChem CID | 69267 |
|---|---|
| CAS | 619-25-0 |
| Molecular Weight (g/mol) | 153.137 |
| MDL Number | MFCD00007273 |
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])CO |
| Synonym | 3-nitrobenzyl alcohol,3-nitrophenyl methanol,m-nitrobenzyl alcohol,benzenemethanol, 3-nitro,benzyl alcohol, m-nitro,3-nitrobenzenemethanol,unii-f829x990iv,ccris 7971,3-nitrophenyl methan-1-ol,3-nitrobenzylalcohol |
| IUPAC Name | (3-nitrophenyl)methanol |
| InChI Key | CWNPOQFCIIFQDM-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO3 |
4-(4-Heptylphenyl)benzoic Acid 95.0+%, TCI America™
CAS: 58573-94-7 Molecular Formula: C20H24O2 Molecular Weight (g/mol): 296.41 MDL Number: MFCD00143231 InChI Key: XVROSBHWACAQRL-UHFFFAOYSA-N Synonym: 4-Heptylbiphenyl-4′C-carboxylic Acid PubChem CID: 3086355 IUPAC Name: 4-(4-heptylphenyl)benzoic acid SMILES: CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O
| PubChem CID | 3086355 |
|---|---|
| CAS | 58573-94-7 |
| Molecular Weight (g/mol) | 296.41 |
| MDL Number | MFCD00143231 |
| SMILES | CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O |
| Synonym | 4-Heptylbiphenyl-4′C-carboxylic Acid |
| IUPAC Name | 4-(4-heptylphenyl)benzoic acid |
| InChI Key | XVROSBHWACAQRL-UHFFFAOYSA-N |
| Molecular Formula | C20H24O2 |
2-Fluoro-3-(trifluoromethyl)benzonitrile 98.0+%, TCI America™
CAS: 146070-35-1 Molecular Formula: C8H3F4N Molecular Weight (g/mol): 189.113 MDL Number: MFCD00061152 InChI Key: NMWOWGXPPBIZNH-UHFFFAOYSA-N Synonym: 2-fluoro-3-trifluoromethyl benzonitrile,3-cyano-2-fluorobenzotrifluoride,.alpha.,.alpha.,.alpha.,2-tetrafluoro-m-tolunitrile,2-fluoro-3-trifluoromethyl benzenecarbonitrile,acmc-20anvp,buttpark 45\01-75,3-trifluoromethyl-2-fluorobenzonitrile,2-fluoro-3-trifluoromethyl-benzonitrile PubChem CID: 518974 IUPAC Name: 2-fluoro-3-(trifluoromethyl)benzonitrile SMILES: C1=CC(=C(C(=C1)C(F)(F)F)F)C#N
| PubChem CID | 518974 |
|---|---|
| CAS | 146070-35-1 |
| Molecular Weight (g/mol) | 189.113 |
| MDL Number | MFCD00061152 |
| SMILES | C1=CC(=C(C(=C1)C(F)(F)F)F)C#N |
| Synonym | 2-fluoro-3-trifluoromethyl benzonitrile,3-cyano-2-fluorobenzotrifluoride,.alpha.,.alpha.,.alpha.,2-tetrafluoro-m-tolunitrile,2-fluoro-3-trifluoromethyl benzenecarbonitrile,acmc-20anvp,buttpark 45\01-75,3-trifluoromethyl-2-fluorobenzonitrile,2-fluoro-3-trifluoromethyl-benzonitrile |
| IUPAC Name | 2-fluoro-3-(trifluoromethyl)benzonitrile |
| InChI Key | NMWOWGXPPBIZNH-UHFFFAOYSA-N |
| Molecular Formula | C8H3F4N |