Benzene and substituted derivatives
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1-Bromo-3,4,5-trifluorobenzene 98.0+%, TCI America™
CAS: 138526-69-9 Molecular Formula: C6H2BrF3 Molecular Weight (g/mol): 210.981 MDL Number: MFCD00070738 InChI Key: HKJCELUUIFFSIN-UHFFFAOYSA-N Synonym: 1-bromo-3,4,5-trifluorobenzene,3,4,5-trifluorobromobenzene,1,2,3-trifluoro-5-bromobenzene,5-bromo-1,2,3-trifluoro-benzene,benzene, 5-bromo-1,2,3-trifluoro,pubchem2304,acmc-1c02k,ksc174s3f,3,4,5-trifluoro-bromobenzene,3,4,5-trifluorophenyl bromide PubChem CID: 611409 IUPAC Name: 5-bromo-1,2,3-trifluorobenzene SMILES: C1=C(C=C(C(=C1F)F)F)Br
| PubChem CID | 611409 |
|---|---|
| CAS | 138526-69-9 |
| Molecular Weight (g/mol) | 210.981 |
| MDL Number | MFCD00070738 |
| SMILES | C1=C(C=C(C(=C1F)F)F)Br |
| Synonym | 1-bromo-3,4,5-trifluorobenzene,3,4,5-trifluorobromobenzene,1,2,3-trifluoro-5-bromobenzene,5-bromo-1,2,3-trifluoro-benzene,benzene, 5-bromo-1,2,3-trifluoro,pubchem2304,acmc-1c02k,ksc174s3f,3,4,5-trifluoro-bromobenzene,3,4,5-trifluorophenyl bromide |
| IUPAC Name | 5-bromo-1,2,3-trifluorobenzene |
| InChI Key | HKJCELUUIFFSIN-UHFFFAOYSA-N |
| Molecular Formula | C6H2BrF3 |
Benzophenone Hydrazone 98.0+%, TCI America™
CAS: 5350-57-2 Molecular Formula: C13H12N2 Molecular Weight (g/mol): 196.253 MDL Number: MFCD00007624 InChI Key: QYCSNMDOZNUZIT-UHFFFAOYSA-N Synonym: benzophenone hydrazone,diphenylmethylene hydrazine,benzophenonehydrazone,methanone, diphenyl-, hydrazone,diphenylmethanone hydrazone,benzophenone, hydrazone,diphenylmethylidene hydrazine,diphenyl ketone hydrazone,benzophenone hydrozone,nsc 43 PubChem CID: 79304 IUPAC Name: benzhydrylidenehydrazine SMILES: C1=CC=C(C=C1)C(=NN)C2=CC=CC=C2
| PubChem CID | 79304 |
|---|---|
| CAS | 5350-57-2 |
| Molecular Weight (g/mol) | 196.253 |
| MDL Number | MFCD00007624 |
| SMILES | C1=CC=C(C=C1)C(=NN)C2=CC=CC=C2 |
| Synonym | benzophenone hydrazone,diphenylmethylene hydrazine,benzophenonehydrazone,methanone, diphenyl-, hydrazone,diphenylmethanone hydrazone,benzophenone, hydrazone,diphenylmethylidene hydrazine,diphenyl ketone hydrazone,benzophenone hydrozone,nsc 43 |
| IUPAC Name | benzhydrylidenehydrazine |
| InChI Key | QYCSNMDOZNUZIT-UHFFFAOYSA-N |
| Molecular Formula | C13H12N2 |
1-Benzyl-3-pyrrolidinol 96.0+%, TCI America™
CAS: 775-15-5 Molecular Formula: C11H15NO Molecular Weight (g/mol): 177.247 MDL Number: MFCD00012132 InChI Key: YQMXOIAIYXXXEE-UHFFFAOYSA-N PubChem CID: 69889 IUPAC Name: 1-benzylpyrrolidin-3-ol SMILES: C1CN(CC1O)CC2=CC=CC=C2
| PubChem CID | 69889 |
|---|---|
| CAS | 775-15-5 |
| Molecular Weight (g/mol) | 177.247 |
| MDL Number | MFCD00012132 |
| SMILES | C1CN(CC1O)CC2=CC=CC=C2 |
| IUPAC Name | 1-benzylpyrrolidin-3-ol |
| InChI Key | YQMXOIAIYXXXEE-UHFFFAOYSA-N |
| Molecular Formula | C11H15NO |
1-Bromo-4-heptylbenzene (stabilized with Copper chip) 96.0+%, TCI America™
CAS: 76287-49-5 Molecular Formula: C13H19Br Molecular Weight (g/mol): 255.199 MDL Number: MFCD00061115 InChI Key: YHKMTIJHJWYYAG-UHFFFAOYSA-N Synonym: 1-bromo-4-n-heptylbenzene,1-4-bromophenyl heptane,4-heptylbromobenzene,benzene, 1-bromo-4-heptyl,4-bromo-1-heptylbenzene,1-bromo-4-heptyl-benzene,acmc-209p2u,1-bromanyl-4-heptyl-benzene,ksc912e9b PubChem CID: 2775100 IUPAC Name: 1-bromo-4-heptylbenzene SMILES: CCCCCCCC1=CC=C(C=C1)Br
| PubChem CID | 2775100 |
|---|---|
| CAS | 76287-49-5 |
| Molecular Weight (g/mol) | 255.199 |
| MDL Number | MFCD00061115 |
| SMILES | CCCCCCCC1=CC=C(C=C1)Br |
| Synonym | 1-bromo-4-n-heptylbenzene,1-4-bromophenyl heptane,4-heptylbromobenzene,benzene, 1-bromo-4-heptyl,4-bromo-1-heptylbenzene,1-bromo-4-heptyl-benzene,acmc-209p2u,1-bromanyl-4-heptyl-benzene,ksc912e9b |
| IUPAC Name | 1-bromo-4-heptylbenzene |
| InChI Key | YHKMTIJHJWYYAG-UHFFFAOYSA-N |
| Molecular Formula | C13H19Br |
Ethyl 4-Bromobenzoate 98.0+%, TCI America™
CAS: 5798-75-4 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 MDL Number: MFCD00016329 InChI Key: XZIAFENWXIQIKR-UHFFFAOYSA-N Synonym: 4-bromobenzoic acid ethyl ester,ethyl p-bromobenzoate,benzoic acid, 4-bromo-, ethyl ester,ethyl4-bromobenzoate,ethyl-4-bromobenzoate,p-ethoxycarbonyl phenyl bromide,benzoic acid, p-bromo-, ethyl ester,4-bromo-benzoic acid ethyl ester,4-bromobenzoic acid, ethyl ester,ethyl-p-bromobenzoate PubChem CID: 22043 IUPAC Name: ethyl 4-bromobenzoate SMILES: CCOC(=O)C1=CC=C(Br)C=C1
| PubChem CID | 22043 |
|---|---|
| CAS | 5798-75-4 |
| Molecular Weight (g/mol) | 229.07 |
| MDL Number | MFCD00016329 |
| SMILES | CCOC(=O)C1=CC=C(Br)C=C1 |
| Synonym | 4-bromobenzoic acid ethyl ester,ethyl p-bromobenzoate,benzoic acid, 4-bromo-, ethyl ester,ethyl4-bromobenzoate,ethyl-4-bromobenzoate,p-ethoxycarbonyl phenyl bromide,benzoic acid, p-bromo-, ethyl ester,4-bromo-benzoic acid ethyl ester,4-bromobenzoic acid, ethyl ester,ethyl-p-bromobenzoate |
| IUPAC Name | ethyl 4-bromobenzoate |
| InChI Key | XZIAFENWXIQIKR-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
(R)-(+)-N-Benzyl-1-phenylethylamine 98.0+%, TCI America™
CAS: 38235-77-7 Molecular Formula: C15H17N Molecular Weight (g/mol): 211.308 MDL Number: MFCD00015010 InChI Key: ZYZHMSJNPCYUTB-CYBMUJFWSA-N Synonym: r-+-n-benzyl-1-phenylethylamine,r-n-benzyl-1-phenylethanamine,r-+-n-benzyl-alpha-methylbenzylamine,benzyl 1r-1-phenylethyl amine,r-n-benzyl-1-phenylethylamine,1r-1-phenylethyl benzylamine,1r-n-benzyl-1-phenylethanamine,s---n-benzyl-alpha-phenethylamine,pubchem5974 PubChem CID: 1268086 IUPAC Name: (1R)-N-benzyl-1-phenylethanamine SMILES: CC(C1=CC=CC=C1)NCC2=CC=CC=C2
| PubChem CID | 1268086 |
|---|---|
| CAS | 38235-77-7 |
| Molecular Weight (g/mol) | 211.308 |
| MDL Number | MFCD00015010 |
| SMILES | CC(C1=CC=CC=C1)NCC2=CC=CC=C2 |
| Synonym | r-+-n-benzyl-1-phenylethylamine,r-n-benzyl-1-phenylethanamine,r-+-n-benzyl-alpha-methylbenzylamine,benzyl 1r-1-phenylethyl amine,r-n-benzyl-1-phenylethylamine,1r-1-phenylethyl benzylamine,1r-n-benzyl-1-phenylethanamine,s---n-benzyl-alpha-phenethylamine,pubchem5974 |
| IUPAC Name | (1R)-N-benzyl-1-phenylethanamine |
| InChI Key | ZYZHMSJNPCYUTB-CYBMUJFWSA-N |
| Molecular Formula | C15H17N |
(2-Bromophenylethynyl)trimethylsilane 98.0+%, TCI America™
CAS: 38274-16-7 Molecular Formula: C11H13BrSi Molecular Weight (g/mol): 253.21 MDL Number: MFCD01321391 InChI Key: FABNGXSCLHXUOH-UHFFFAOYSA-N Synonym: 2-bromophenylethynyl trimethylsilane,2-bromophenyl ethynyl trimethylsilane,2-2-bromophenyl ethynyl trimethylsilane,acmc-20appv,2-bromophenyl trimethylsilyl acetylene,2-2-bromophenyl ethynyl-trimethylsilane,benzene,1-bromo-2-2-trimethylsilyl ethynyl PubChem CID: 4547398 IUPAC Name: [2-(2-bromophenyl)ethynyl]trimethylsilane SMILES: C[Si](C)(C)C#CC1=CC=CC=C1Br
| PubChem CID | 4547398 |
|---|---|
| CAS | 38274-16-7 |
| Molecular Weight (g/mol) | 253.21 |
| MDL Number | MFCD01321391 |
| SMILES | C[Si](C)(C)C#CC1=CC=CC=C1Br |
| Synonym | 2-bromophenylethynyl trimethylsilane,2-bromophenyl ethynyl trimethylsilane,2-2-bromophenyl ethynyl trimethylsilane,acmc-20appv,2-bromophenyl trimethylsilyl acetylene,2-2-bromophenyl ethynyl-trimethylsilane,benzene,1-bromo-2-2-trimethylsilyl ethynyl |
| IUPAC Name | [2-(2-bromophenyl)ethynyl]trimethylsilane |
| InChI Key | FABNGXSCLHXUOH-UHFFFAOYSA-N |
| Molecular Formula | C11H13BrSi |
2-Bromo-4-methylaniline 98.0+%, TCI America™
CAS: 583-68-6 Molecular Formula: C7H8BrN Molecular Weight (g/mol): 186.052 MDL Number: MFCD00007635 InChI Key: UVRRJILIXQAAFK-UHFFFAOYSA-N Synonym: 2-bromo-p-toluidine,benzenamine, 2-bromo-4-methyl,4-amino-3-bromotoluene,2-bromo-4-methylbenzenamine,p-toluidine, 2-bromo,2-bromo-4-methyl-phenylamine,3-bromo-4-aminotoluene,4-methyl-2-bromoaniline,2-bromo-4-methyl aniline,2-bromo-4-methyl-aniline PubChem CID: 11422 IUPAC Name: 2-bromo-4-methylaniline SMILES: CC1=CC(=C(C=C1)N)Br
| PubChem CID | 11422 |
|---|---|
| CAS | 583-68-6 |
| Molecular Weight (g/mol) | 186.052 |
| MDL Number | MFCD00007635 |
| SMILES | CC1=CC(=C(C=C1)N)Br |
| Synonym | 2-bromo-p-toluidine,benzenamine, 2-bromo-4-methyl,4-amino-3-bromotoluene,2-bromo-4-methylbenzenamine,p-toluidine, 2-bromo,2-bromo-4-methyl-phenylamine,3-bromo-4-aminotoluene,4-methyl-2-bromoaniline,2-bromo-4-methyl aniline,2-bromo-4-methyl-aniline |
| IUPAC Name | 2-bromo-4-methylaniline |
| InChI Key | UVRRJILIXQAAFK-UHFFFAOYSA-N |
| Molecular Formula | C7H8BrN |
2-Methoxyphenylhydrazine Hydrochloride 98.0+%, TCI America™
CAS: 6971-45-5 Molecular Formula: C7H11ClN2O Molecular Weight (g/mol): 174.628 MDL Number: MFCD00035456 InChI Key: HECSHXUNOVTAIJ-UHFFFAOYSA-N Synonym: 2-Hydrazinoanisole Hydrochloride PubChem CID: 2849445 IUPAC Name: (2-methoxyphenyl)hydrazine;hydrochloride SMILES: COC1=CC=CC=C1NN.Cl
| PubChem CID | 2849445 |
|---|---|
| CAS | 6971-45-5 |
| Molecular Weight (g/mol) | 174.628 |
| MDL Number | MFCD00035456 |
| SMILES | COC1=CC=CC=C1NN.Cl |
| Synonym | 2-Hydrazinoanisole Hydrochloride |
| IUPAC Name | (2-methoxyphenyl)hydrazine;hydrochloride |
| InChI Key | HECSHXUNOVTAIJ-UHFFFAOYSA-N |
| Molecular Formula | C7H11ClN2O |
2,4,5-Trifluorobenzoyl Chloride 98.0+%, TCI America™
CAS: 88419-56-1 Molecular Formula: C7H2ClF3O Molecular Weight (g/mol): 194.54 MDL Number: MFCD00061204 InChI Key: STBGCAUUOPNJBH-UHFFFAOYSA-N Synonym: 2,4,5-trifluorobenzoylchloride,benzoyl chloride, 2,4,5-trifluoro,2,4,5-tris fluoranyl benzoyl chloride,pubchem9716,acmc-209qt0,2,4,5-trifluorobenzoyl-chloride,stbgcauuopnjbh-uhfffaoysa,timtec-bb sbb006657,2,4,5-trifluoro-benzoyl chloride,2,4,5-trifluorobenzoyl chloride PubChem CID: 145164 IUPAC Name: 2,4,5-trifluorobenzoyl chloride SMILES: FC1=CC(F)=C(C=C1F)C(Cl)=O
| PubChem CID | 145164 |
|---|---|
| CAS | 88419-56-1 |
| Molecular Weight (g/mol) | 194.54 |
| MDL Number | MFCD00061204 |
| SMILES | FC1=CC(F)=C(C=C1F)C(Cl)=O |
| Synonym | 2,4,5-trifluorobenzoylchloride,benzoyl chloride, 2,4,5-trifluoro,2,4,5-tris fluoranyl benzoyl chloride,pubchem9716,acmc-209qt0,2,4,5-trifluorobenzoyl-chloride,stbgcauuopnjbh-uhfffaoysa,timtec-bb sbb006657,2,4,5-trifluoro-benzoyl chloride,2,4,5-trifluorobenzoyl chloride |
| IUPAC Name | 2,4,5-trifluorobenzoyl chloride |
| InChI Key | STBGCAUUOPNJBH-UHFFFAOYSA-N |
| Molecular Formula | C7H2ClF3O |
Tris(pentafluorophenyl)borane 98.0+%, TCI America™
CAS: 1109-15-5 Molecular Formula: C18BF15 Molecular Weight (g/mol): 511.98 MDL Number: MFCD00269813 InChI Key: OBAJXDYVZBHCGT-UHFFFAOYSA-N Synonym: tris pentafluorophenyl borane,tris perfluorophenyl borane,tris pentafluorophenyl boron,tris 2,3,4,5,6-pentafluorophenyl borane,unii-i3wu5e2578,tris pentafluorophenyl-borane,borane, tris pentafluorophenyl,borane, tris 2,3,4,5,6-pentafluorophenyl,perfluorotriphenylboron,zlchem 1272 PubChem CID: 582056 IUPAC Name: tris(2,3,4,5,6-pentafluorophenyl)borane SMILES: FC1=C(F)C(F)=C(B(C2=C(F)C(F)=C(F)C(F)=C2F)C2=C(F)C(F)=C(F)C(F)=C2F)C(F)=C1F
| PubChem CID | 582056 |
|---|---|
| CAS | 1109-15-5 |
| Molecular Weight (g/mol) | 511.98 |
| MDL Number | MFCD00269813 |
| SMILES | FC1=C(F)C(F)=C(B(C2=C(F)C(F)=C(F)C(F)=C2F)C2=C(F)C(F)=C(F)C(F)=C2F)C(F)=C1F |
| Synonym | tris pentafluorophenyl borane,tris perfluorophenyl borane,tris pentafluorophenyl boron,tris 2,3,4,5,6-pentafluorophenyl borane,unii-i3wu5e2578,tris pentafluorophenyl-borane,borane, tris pentafluorophenyl,borane, tris 2,3,4,5,6-pentafluorophenyl,perfluorotriphenylboron,zlchem 1272 |
| IUPAC Name | tris(2,3,4,5,6-pentafluorophenyl)borane |
| InChI Key | OBAJXDYVZBHCGT-UHFFFAOYSA-N |
| Molecular Formula | C18BF15 |
2-Fluoro-5-formylbenzonitrile 98.0+%, TCI America™
CAS: 218301-22-5 Molecular Formula: C8H4FNO Molecular Weight (g/mol): 149.124 MDL Number: MFCD01863558 InChI Key: MOFRJTLODZILCR-UHFFFAOYSA-N Synonym: 3-cyano-4-fluorobenzaldehyde,4-fluoro-3-cyanobenzaldehyde,2-fluoro-5-formyl-benzonitrile,benzonitrile, 2-fluoro-5-formyl,2-fluoro-5-formylbenzenecarbonitrile,2-fluor-5-formylbenzonitrile,10014 2-fluoro-5-formyl benzonitrile,pubchem2252,acmc-1cfa9,fluoro-5-formylbenzonitrile PubChem CID: 2769582 IUPAC Name: 2-fluoro-5-formylbenzonitrile SMILES: C1=CC(=C(C=C1C=O)C#N)F
| PubChem CID | 2769582 |
|---|---|
| CAS | 218301-22-5 |
| Molecular Weight (g/mol) | 149.124 |
| MDL Number | MFCD01863558 |
| SMILES | C1=CC(=C(C=C1C=O)C#N)F |
| Synonym | 3-cyano-4-fluorobenzaldehyde,4-fluoro-3-cyanobenzaldehyde,2-fluoro-5-formyl-benzonitrile,benzonitrile, 2-fluoro-5-formyl,2-fluoro-5-formylbenzenecarbonitrile,2-fluor-5-formylbenzonitrile,10014 2-fluoro-5-formyl benzonitrile,pubchem2252,acmc-1cfa9,fluoro-5-formylbenzonitrile |
| IUPAC Name | 2-fluoro-5-formylbenzonitrile |
| InChI Key | MOFRJTLODZILCR-UHFFFAOYSA-N |
| Molecular Formula | C8H4FNO |
2-Iodobenzoyl Chloride 97.0+%, TCI America™
CAS: 609-67-6 Molecular Formula: C7H4ClIO Molecular Weight (g/mol): 266.462 MDL Number: MFCD00001040 InChI Key: MVIVDSWUOGNODP-UHFFFAOYSA-N PubChem CID: 69112 IUPAC Name: 2-iodobenzoyl chloride SMILES: C1=CC=C(C(=C1)C(=O)Cl)I
| PubChem CID | 69112 |
|---|---|
| CAS | 609-67-6 |
| Molecular Weight (g/mol) | 266.462 |
| MDL Number | MFCD00001040 |
| SMILES | C1=CC=C(C(=C1)C(=O)Cl)I |
| IUPAC Name | 2-iodobenzoyl chloride |
| InChI Key | MVIVDSWUOGNODP-UHFFFAOYSA-N |
| Molecular Formula | C7H4ClIO |
2-Iodobenzonitrile 98.0+%, TCI America™
CAS: 4387-36-4 Molecular Formula: C7H4IN Molecular Weight (g/mol): 229.02 InChI Key: JDDAFHUEOVUDFJ-UHFFFAOYSA-N Synonym: 1-cyano-2-iodobenzene,benzonitrile, 2-iodo,o-iodobenzonitrile,2-iodobenzenecarbonitrile,iodobenzonitrile,2-cyanoiodobenzene,pubchem3932,acmc-209jvq,2-iodobenzonitrile,ksc235m8d PubChem CID: 2759358 IUPAC Name: 2-iodobenzonitrile SMILES: C1=CC=C(C(=C1)C#N)I
| PubChem CID | 2759358 |
|---|---|
| CAS | 4387-36-4 |
| Molecular Weight (g/mol) | 229.02 |
| SMILES | C1=CC=C(C(=C1)C#N)I |
| Synonym | 1-cyano-2-iodobenzene,benzonitrile, 2-iodo,o-iodobenzonitrile,2-iodobenzenecarbonitrile,iodobenzonitrile,2-cyanoiodobenzene,pubchem3932,acmc-209jvq,2-iodobenzonitrile,ksc235m8d |
| IUPAC Name | 2-iodobenzonitrile |
| InChI Key | JDDAFHUEOVUDFJ-UHFFFAOYSA-N |
| Molecular Formula | C7H4IN |