Benzene and substituted derivatives
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2,3,5,6-Tetrafluoro-4-methylbenzoic Acid 97.0+%, TCI America™
CAS: 652-32-4 Molecular Formula: C8H4F4O2 Molecular Weight (g/mol): 208.112 InChI Key: COOULIOYEXBFDT-UHFFFAOYSA-N Synonym: 2,3,5,6-tetrafluoro-p-toluic acid,4-methyl-2,3,5,6-tetrafluorobenzoic acid,p-toluic acid, 2,3,5,6-tetrafluoro,2,3,5,6-tetrafluoro-4-methyl-benzoic acid,tetrafluoro-p-toluic acid,acmc-1az53,2,3,5,6-tetrafluoro-4-methylbenzoicacid,2,3,5,6-tetrafluoro-4-toluic acid,4-carboxy-2,3,5,6-tetrafluorotoluene PubChem CID: 69548 IUPAC Name: 2,3,5,6-tetrafluoro-4-methylbenzoic acid SMILES: CC1=C(C(=C(C(=C1F)F)C(=O)O)F)F
| PubChem CID | 69548 |
|---|---|
| CAS | 652-32-4 |
| Molecular Weight (g/mol) | 208.112 |
| SMILES | CC1=C(C(=C(C(=C1F)F)C(=O)O)F)F |
| Synonym | 2,3,5,6-tetrafluoro-p-toluic acid,4-methyl-2,3,5,6-tetrafluorobenzoic acid,p-toluic acid, 2,3,5,6-tetrafluoro,2,3,5,6-tetrafluoro-4-methyl-benzoic acid,tetrafluoro-p-toluic acid,acmc-1az53,2,3,5,6-tetrafluoro-4-methylbenzoicacid,2,3,5,6-tetrafluoro-4-toluic acid,4-carboxy-2,3,5,6-tetrafluorotoluene |
| IUPAC Name | 2,3,5,6-tetrafluoro-4-methylbenzoic acid |
| InChI Key | COOULIOYEXBFDT-UHFFFAOYSA-N |
| Molecular Formula | C8H4F4O2 |
4-Bromo-3-methylbenzoic Acid 97.0+%, TCI America™
CAS: 7697-28-1 Molecular Formula: C8H6BrO2 Molecular Weight (g/mol): 214.04 MDL Number: MFCD00039526 InChI Key: KWVXDZLVCISXIB-UHFFFAOYSA-M Synonym: 4-bromo-m-toluic acid,4-bromo-3-methyl-benzoic acid,4-bromo-3-methylbenzoicacid,3-methyl-4-bromobenzoic acid,4-bromo-3-methyl benzoic acid,benzoic acid, 4-bromo-3-methyl,pubchem3807,4bromo-3-methylbenzoic acid,4-bromo-5-methylbenzoic acid,ksc379g0b PubChem CID: 82131 IUPAC Name: 4-bromo-3-methylbenzoate SMILES: CC1=CC(=CC=C1Br)C([O-])=O
| PubChem CID | 82131 |
|---|---|
| CAS | 7697-28-1 |
| Molecular Weight (g/mol) | 214.04 |
| MDL Number | MFCD00039526 |
| SMILES | CC1=CC(=CC=C1Br)C([O-])=O |
| Synonym | 4-bromo-m-toluic acid,4-bromo-3-methyl-benzoic acid,4-bromo-3-methylbenzoicacid,3-methyl-4-bromobenzoic acid,4-bromo-3-methyl benzoic acid,benzoic acid, 4-bromo-3-methyl,pubchem3807,4bromo-3-methylbenzoic acid,4-bromo-5-methylbenzoic acid,ksc379g0b |
| IUPAC Name | 4-bromo-3-methylbenzoate |
| InChI Key | KWVXDZLVCISXIB-UHFFFAOYSA-M |
| Molecular Formula | C8H6BrO2 |
3-Chlorobenzoyl Chloride 98.0+%, TCI America™
CAS: 618-46-2 Molecular Formula: C7H4Cl2O Molecular Weight (g/mol): 175.01 MDL Number: MFCD00000671 InChI Key: WHIHIKVIWVIIER-UHFFFAOYSA-N Synonym: m-chlorobenzoyl chloride,benzoyl chloride, 3-chloro,benzoyl chloride, m-chloro,m-chlorobenzoylchloride,3-chlorobenzoylchloride,benzoylchloride, 3-chloro,mcoc,3-chlorobenzoic acid chloride,ccris 8615,3chlorobenzoyl chloride PubChem CID: 69252 IUPAC Name: 3-chlorobenzoyl chloride SMILES: ClC(=O)C1=CC=CC(Cl)=C1
| PubChem CID | 69252 |
|---|---|
| CAS | 618-46-2 |
| Molecular Weight (g/mol) | 175.01 |
| MDL Number | MFCD00000671 |
| SMILES | ClC(=O)C1=CC=CC(Cl)=C1 |
| Synonym | m-chlorobenzoyl chloride,benzoyl chloride, 3-chloro,benzoyl chloride, m-chloro,m-chlorobenzoylchloride,3-chlorobenzoylchloride,benzoylchloride, 3-chloro,mcoc,3-chlorobenzoic acid chloride,ccris 8615,3chlorobenzoyl chloride |
| IUPAC Name | 3-chlorobenzoyl chloride |
| InChI Key | WHIHIKVIWVIIER-UHFFFAOYSA-N |
| Molecular Formula | C7H4Cl2O |
3',4'-Dichlorosalicylanilide 98.0+%, TCI America™
CAS: 24448-73-5 Molecular Formula: C13H9Cl2NO2 Molecular Weight (g/mol): 282.12 MDL Number: MFCD00020023 InChI Key: XWZCOIHEGFREJR-UHFFFAOYSA-N PubChem CID: 352402 IUPAC Name: N-(3,4-dichlorophenyl)-2-hydroxybenzamide SMILES: C1=CC=C(C(=C1)C(=O)NC2=CC(=C(C=C2)Cl)Cl)O
| PubChem CID | 352402 |
|---|---|
| CAS | 24448-73-5 |
| Molecular Weight (g/mol) | 282.12 |
| MDL Number | MFCD00020023 |
| SMILES | C1=CC=C(C(=C1)C(=O)NC2=CC(=C(C=C2)Cl)Cl)O |
| IUPAC Name | N-(3,4-dichlorophenyl)-2-hydroxybenzamide |
| InChI Key | XWZCOIHEGFREJR-UHFFFAOYSA-N |
| Molecular Formula | C13H9Cl2NO2 |
2-Chlorobenzohydrazide 98.0+%, TCI America™
CAS: 5814-05-1 Molecular Formula: C7H7ClN2O Molecular Weight (g/mol): 170.60 MDL Number: MFCD00007597 InChI Key: KPPNLSKVTKSSTG-UHFFFAOYSA-N Synonym: 2-chlorobenzhydrazide,2-chlorobenzoic hydrazide,2-chlorobenzoic acid hydrazide,2-chlorobenzene-1-carbohydrazide,benzoylhydrazine, o-chloro,benzoic acid, 2-chloro-, hydrazide,2-chlorobenzenecarbohydrazide,chlorobenzohydrazide,o-chlorobenzhydrazide,2clphcon2 PubChem CID: 79883 IUPAC Name: 2-chlorobenzohydrazide SMILES: C1=CC=C(C(=C1)C(=O)NN)Cl
| PubChem CID | 79883 |
|---|---|
| CAS | 5814-05-1 |
| Molecular Weight (g/mol) | 170.60 |
| MDL Number | MFCD00007597 |
| SMILES | C1=CC=C(C(=C1)C(=O)NN)Cl |
| Synonym | 2-chlorobenzhydrazide,2-chlorobenzoic hydrazide,2-chlorobenzoic acid hydrazide,2-chlorobenzene-1-carbohydrazide,benzoylhydrazine, o-chloro,benzoic acid, 2-chloro-, hydrazide,2-chlorobenzenecarbohydrazide,chlorobenzohydrazide,o-chlorobenzhydrazide,2clphcon2 |
| IUPAC Name | 2-chlorobenzohydrazide |
| InChI Key | KPPNLSKVTKSSTG-UHFFFAOYSA-N |
| Molecular Formula | C7H7ClN2O |
2-Bromobenzohydrazide 98.0+%, TCI America™
CAS: 29418-67-5 Molecular Formula: C7H7BrN2O Molecular Weight (g/mol): 215.05 MDL Number: MFCD00051577 InChI Key: PQNLAYLOCZKPIY-UHFFFAOYSA-N Synonym: 2-bromobenzhydrazide,2-bromobenzoic hydrazide,benzoylhydrazine, o-bromo,2-bromobenzoyl hydrazine,2-bromo-benzoic acid hydrazide,2-bromobenzenecarbohydrazide,2-bromobenzoic acid hydrazide,bromobenzhydrazide,pubchem3742,2-bromobenzoylhydrazine PubChem CID: 101460 IUPAC Name: 2-bromobenzohydrazide SMILES: NNC(=O)C1=CC=CC=C1Br
| PubChem CID | 101460 |
|---|---|
| CAS | 29418-67-5 |
| Molecular Weight (g/mol) | 215.05 |
| MDL Number | MFCD00051577 |
| SMILES | NNC(=O)C1=CC=CC=C1Br |
| Synonym | 2-bromobenzhydrazide,2-bromobenzoic hydrazide,benzoylhydrazine, o-bromo,2-bromobenzoyl hydrazine,2-bromo-benzoic acid hydrazide,2-bromobenzenecarbohydrazide,2-bromobenzoic acid hydrazide,bromobenzhydrazide,pubchem3742,2-bromobenzoylhydrazine |
| IUPAC Name | 2-bromobenzohydrazide |
| InChI Key | PQNLAYLOCZKPIY-UHFFFAOYSA-N |
| Molecular Formula | C7H7BrN2O |
2,3,5,6-Tetrafluorobenzoic Acid 98.0+%, TCI America™
CAS: 652-18-6 Molecular Formula: C7H2F4O2 Molecular Weight (g/mol): 194.085 MDL Number: MFCD00002408 InChI Key: KVLBXIOFJUWSJQ-UHFFFAOYSA-N Synonym: benzoic acid, 2,3,5,6-tetrafluoro,2,3,5,6-tetrafluorobenzoicacid,pubchem1341,acmc-1avk1,benzoic acid,2,3,5,6-tetrafluoro PubChem CID: 567533 IUPAC Name: 2,3,5,6-tetrafluorobenzoic acid SMILES: C1=C(C(=C(C(=C1F)F)C(=O)O)F)F
| PubChem CID | 567533 |
|---|---|
| CAS | 652-18-6 |
| Molecular Weight (g/mol) | 194.085 |
| MDL Number | MFCD00002408 |
| SMILES | C1=C(C(=C(C(=C1F)F)C(=O)O)F)F |
| Synonym | benzoic acid, 2,3,5,6-tetrafluoro,2,3,5,6-tetrafluorobenzoicacid,pubchem1341,acmc-1avk1,benzoic acid,2,3,5,6-tetrafluoro |
| IUPAC Name | 2,3,5,6-tetrafluorobenzoic acid |
| InChI Key | KVLBXIOFJUWSJQ-UHFFFAOYSA-N |
| Molecular Formula | C7H2F4O2 |
Methyl 2,4-Difluorobenzoate 98.0+%, TCI America™
CAS: 106614-28-2 Molecular Formula: C8H6F2O2 Molecular Weight (g/mol): 172.131 MDL Number: MFCD03093799 InChI Key: YQUHULOBTDYMAG-UHFFFAOYSA-N Synonym: 2,4-difluoro-benzoic acid methyl ester,2,4-difluorobenzoic acid methyl ester,methyl-2,4-difluorobenzoate,methyl 2,4-difluoro benzoate,benzoic acid, 2,4-difluoro-, methyl ester,pubchem15678,acmc-1c4sx,methyl 2,4-diflourobenzoate,ksc494g3p,rarechem al bf 0213 PubChem CID: 2782897 IUPAC Name: methyl 2,4-difluorobenzoate SMILES: COC(=O)C1=C(C=C(C=C1)F)F
| PubChem CID | 2782897 |
|---|---|
| CAS | 106614-28-2 |
| Molecular Weight (g/mol) | 172.131 |
| MDL Number | MFCD03093799 |
| SMILES | COC(=O)C1=C(C=C(C=C1)F)F |
| Synonym | 2,4-difluoro-benzoic acid methyl ester,2,4-difluorobenzoic acid methyl ester,methyl-2,4-difluorobenzoate,methyl 2,4-difluoro benzoate,benzoic acid, 2,4-difluoro-, methyl ester,pubchem15678,acmc-1c4sx,methyl 2,4-diflourobenzoate,ksc494g3p,rarechem al bf 0213 |
| IUPAC Name | methyl 2,4-difluorobenzoate |
| InChI Key | YQUHULOBTDYMAG-UHFFFAOYSA-N |
| Molecular Formula | C8H6F2O2 |
1,3-Dibromobenzene 97.0+%, TCI America™
CAS: 108-36-1 Molecular Formula: C6H4Br2 Molecular Weight (g/mol): 235.91 MDL Number: MFCD00000078 InChI Key: JSRLURSZEMLAFO-UHFFFAOYSA-N Synonym: m-dibromobenzene,benzene, 1,3-dibromo,benzene, m-dibromo,unii-74ef6kh8tc,1,3-dibromo-benzene,74ef6kh8tc,1,3-dibromo benzene,3,5-dibromobenzene,1,3-dibrormobenzene,1, 3-dibromobenzene PubChem CID: 7927 ChEBI: CHEBI:37151 IUPAC Name: 1,3-dibromobenzene SMILES: BrC1=CC(Br)=CC=C1
| PubChem CID | 7927 |
|---|---|
| CAS | 108-36-1 |
| Molecular Weight (g/mol) | 235.91 |
| ChEBI | CHEBI:37151 |
| MDL Number | MFCD00000078 |
| SMILES | BrC1=CC(Br)=CC=C1 |
| Synonym | m-dibromobenzene,benzene, 1,3-dibromo,benzene, m-dibromo,unii-74ef6kh8tc,1,3-dibromo-benzene,74ef6kh8tc,1,3-dibromo benzene,3,5-dibromobenzene,1,3-dibrormobenzene,1, 3-dibromobenzene |
| IUPAC Name | 1,3-dibromobenzene |
| InChI Key | JSRLURSZEMLAFO-UHFFFAOYSA-N |
| Molecular Formula | C6H4Br2 |
1-Bromo-4-butylbenzene 97.0+%, TCI America™
CAS: 41492-05-1 Molecular Formula: C10H13Br Molecular Weight (g/mol): 213.118 MDL Number: MFCD00040934 InChI Key: BRGVKVZXDWGJBX-UHFFFAOYSA-N Synonym: 1-bromo-4-n-butylbenzene,4-bromo-n-butylbenzene,4-n-butylbromobenzene,1-4-bromophenyl butane,benzene, 1-bromo-4-butyl,4-butyl bromobenzene,4-butyl-bromobenzene,4-1-butylbromobenzene,4-butyl phenylbromide,pubchem15109 PubChem CID: 521059 IUPAC Name: 1-bromo-4-butylbenzene SMILES: CCCCC1=CC=C(C=C1)Br
| PubChem CID | 521059 |
|---|---|
| CAS | 41492-05-1 |
| Molecular Weight (g/mol) | 213.118 |
| MDL Number | MFCD00040934 |
| SMILES | CCCCC1=CC=C(C=C1)Br |
| Synonym | 1-bromo-4-n-butylbenzene,4-bromo-n-butylbenzene,4-n-butylbromobenzene,1-4-bromophenyl butane,benzene, 1-bromo-4-butyl,4-butyl bromobenzene,4-butyl-bromobenzene,4-1-butylbromobenzene,4-butyl phenylbromide,pubchem15109 |
| IUPAC Name | 1-bromo-4-butylbenzene |
| InChI Key | BRGVKVZXDWGJBX-UHFFFAOYSA-N |
| Molecular Formula | C10H13Br |
| PubChem CID | 79599 |
|---|---|
| CAS | 5467-74-3 |
| MDL Number | MFCD00002104 |
| Physical Form | Crystalline Powder |
| SMILES | B(C1=CC=C(C=C1)Br)(O)O |
| Synonym | 4-bromophenyl boronic acid,4-bromobenzeneboronic acid,4-bromophenylboric acid,p-bromophenylboronic acid,p-bromophenylboric acid |
| TSCA | No |
| RTECS Number | CY8650000 |
| IUPAC Name | (4-bromophenyl)boronic acid |
| InChI Key | QBLFZIBJXUQVRF-UHFFFAOYSA-N |
| Molecular Formula | C6H6BBrO2 |
| Formula Weight | 200.83 |
| Melting Point | 292°C |
4-Bromo-2,5-difluoronitrobenzene 98.0+%, TCI America™
CAS: 167415-27-2 Molecular Formula: C6H2BrF2NO2 Molecular Weight (g/mol): 237.99 MDL Number: MFCD00042184 InChI Key: GJFYMYJYPARISZ-UHFFFAOYSA-N Synonym: 4-bromo-2,5-difluoronitrobenzene,4-bromo-2,5-difluoro-1-nitrobenzene,benzene, 1-bromo-2,5-difluoro-4-nitro,buttpark 29\01-58,1-bromo-2,5-difluoro-4-nitro-benzene,pubchem8498,zlchem 1046,acmc-209dwg,intermediates-zcf02256,ksc495e4h PubChem CID: 2736286 IUPAC Name: 1-bromo-2,5-difluoro-4-nitrobenzene SMILES: [O-][N+](=O)C1=CC(F)=C(Br)C=C1F
| PubChem CID | 2736286 |
|---|---|
| CAS | 167415-27-2 |
| Molecular Weight (g/mol) | 237.99 |
| MDL Number | MFCD00042184 |
| SMILES | [O-][N+](=O)C1=CC(F)=C(Br)C=C1F |
| Synonym | 4-bromo-2,5-difluoronitrobenzene,4-bromo-2,5-difluoro-1-nitrobenzene,benzene, 1-bromo-2,5-difluoro-4-nitro,buttpark 29\01-58,1-bromo-2,5-difluoro-4-nitro-benzene,pubchem8498,zlchem 1046,acmc-209dwg,intermediates-zcf02256,ksc495e4h |
| IUPAC Name | 1-bromo-2,5-difluoro-4-nitrobenzene |
| InChI Key | GJFYMYJYPARISZ-UHFFFAOYSA-N |
| Molecular Formula | C6H2BrF2NO2 |
| PubChem CID | 2734689 |
|---|---|
| CAS | 117695-55-3 |
| Molecular Weight (g/mol) | 279.722 |
| MDL Number | MFCD01075725 |
| Physical Form | Crystalline Powder |
| SMILES | B(C1=CC(=CC(=C1)Br)Br)(O)O |
| TSCA | No |
| IUPAC Name | (3,5-dibromophenyl)boronic acid |
| InChI Key | WQBLCGDZYFKINX-UHFFFAOYSA-N |
| Molecular Formula | C6H5BBr2O2 |
| Formula Weight | 279.72 |
Bis(4-bromophenyl)acetylene 98.0+%, TCI America™
CAS: 2789-89-1 Molecular Formula: C14H8Br2 Molecular Weight (g/mol): 336.03 MDL Number: MFCD00185147 InChI Key: FJQGIJIHOXZMMJ-UHFFFAOYSA-N Synonym: 1,2-bis 4-bromophenyl ethyne,bis 4-bromophenyl acetylene,1-bromo-4-2-4-bromophenyl ethynyl benzene,bis-4-bromophenyl acetylene,1,2-bis 4-bromophenyl acetylene,benzene, 1,1'-1,2-ethynediyl bis 4-bromo,4,4'-dibromotolan,4,4'-dibromotolane,bis-p-bromophenyl acetylene,1 pound not2-bis 4-bromophenyl acetylene PubChem CID: 3464242 IUPAC Name: 1-bromo-4-[2-(4-bromophenyl)ethynyl]benzene SMILES: BrC1=CC=C(C=C1)C#CC1=CC=C(Br)C=C1
| PubChem CID | 3464242 |
|---|---|
| CAS | 2789-89-1 |
| Molecular Weight (g/mol) | 336.03 |
| MDL Number | MFCD00185147 |
| SMILES | BrC1=CC=C(C=C1)C#CC1=CC=C(Br)C=C1 |
| Synonym | 1,2-bis 4-bromophenyl ethyne,bis 4-bromophenyl acetylene,1-bromo-4-2-4-bromophenyl ethynyl benzene,bis-4-bromophenyl acetylene,1,2-bis 4-bromophenyl acetylene,benzene, 1,1'-1,2-ethynediyl bis 4-bromo,4,4'-dibromotolan,4,4'-dibromotolane,bis-p-bromophenyl acetylene,1 pound not2-bis 4-bromophenyl acetylene |
| IUPAC Name | 1-bromo-4-[2-(4-bromophenyl)ethynyl]benzene |
| InChI Key | FJQGIJIHOXZMMJ-UHFFFAOYSA-N |
| Molecular Formula | C14H8Br2 |
4-Fluoro-3-methylaniline 98.0+%, TCI America™
CAS: 452-69-7 Molecular Formula: C7H8FN Molecular Weight (g/mol): 125.15 MDL Number: MFCD00025294 InChI Key: NYMDPDNETOLVBS-UHFFFAOYSA-N Synonym: 2-fluoro-5-aminotoluene,4-fluoro-m-toluidine,5-amino-2-fluorotoluene,4-fluoro-3-methylbenzenamine,4-fluoro-3-methylphenylamine,benzenamine, 4-fluoro-3-methyl,4-fluoro-3-methyl aniline,4-fluoro-3-methyl-aniline,4-fluor-3-methylanilin,pubchem1513 PubChem CID: 67981 IUPAC Name: 4-fluoro-3-methylaniline SMILES: CC1=CC(N)=CC=C1F
| PubChem CID | 67981 |
|---|---|
| CAS | 452-69-7 |
| Molecular Weight (g/mol) | 125.15 |
| MDL Number | MFCD00025294 |
| SMILES | CC1=CC(N)=CC=C1F |
| Synonym | 2-fluoro-5-aminotoluene,4-fluoro-m-toluidine,5-amino-2-fluorotoluene,4-fluoro-3-methylbenzenamine,4-fluoro-3-methylphenylamine,benzenamine, 4-fluoro-3-methyl,4-fluoro-3-methyl aniline,4-fluoro-3-methyl-aniline,4-fluor-3-methylanilin,pubchem1513 |
| IUPAC Name | 4-fluoro-3-methylaniline |
| InChI Key | NYMDPDNETOLVBS-UHFFFAOYSA-N |
| Molecular Formula | C7H8FN |