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Benzene and substituted derivatives

Benzene is an aromatic organic molecule composed of six carbon atoms and six hydrogen atoms that form a ring. Includes substituted derivative compounds.
Phenylpropenes (25)
Fluorobenzenes (8)
Aminobenzoic acids and derivatives (6)
Bromobenzenes (5)
Hydroxybenzoic Acid Derivatives (5)
Benzoyl derivatives (4)
Iodobenzenes (3)
Nitrobenzoic acids and derivatives (3)
Phenylmethylamines (3)
Benzenesulfonamides (2)
Nitrobenzenes (2)
Aminotoluenes (1)
N-phenylthioureas (1)
Phenylpropanes (1)
Benzyl Derivatives (1)

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1

p-Tolylthiourea 98.0+%, TCI America™

CAS: 622-52-6 Molecular Formula: C8H10N2S Molecular Weight (g/mol): 166.24 MDL Number: MFCD00041190 InChI Key: VXLFMCZPFIKKDZ-UHFFFAOYSA-N Synonym: p-tolylthiourea,1-p-tolyl thiourea,1-p-tolylthiourea,1-4-methylphenyl thiourea,n-4-methylphenyl thiourea,4-methylphenyl thiourea,urea, 2-thio-1-p-tolyl,n-p-tolylthiourea,p-tolylthiocarbamide,thiourea, 4-methylphenyl PubChem CID: 722833 IUPAC Name: (4-methylphenyl)thiourea SMILES: CC1=CC=C(NC(N)=S)C=C1

PubChem CID 722833
CAS 622-52-6
Molecular Weight (g/mol) 166.24
MDL Number MFCD00041190
SMILES CC1=CC=C(NC(N)=S)C=C1
Synonym p-tolylthiourea,1-p-tolyl thiourea,1-p-tolylthiourea,1-4-methylphenyl thiourea,n-4-methylphenyl thiourea,4-methylphenyl thiourea,urea, 2-thio-1-p-tolyl,n-p-tolylthiourea,p-tolylthiocarbamide,thiourea, 4-methylphenyl
IUPAC Name (4-methylphenyl)thiourea
InChI Key VXLFMCZPFIKKDZ-UHFFFAOYSA-N
Molecular Formula C8H10N2S
2

2-Fluorobenzaldehyde 98.0+%, TCI America™

CAS: 446-52-6 Molecular Formula: C7H5FO Molecular Weight (g/mol): 124.114 MDL Number: MFCD00003302 InChI Key: ZWDVQMVZZYIAHO-UHFFFAOYSA-N Synonym: o-fluorobenzaldehyde,benzaldehyde, 2-fluoro,benzaldehyde, o-fluoro,unii-7zx20dxb9z,2-fluor-benzaldehyd,2-fluoro-benzaldehyde,benzaldehyde, fluoro,ortho-fluorobenzaldehyde,7zx20dxb9z,fluorobenzaldehyde PubChem CID: 67970 IUPAC Name: 2-fluorobenzaldehyde SMILES: C1=CC=C(C(=C1)C=O)F

PubChem CID 67970
CAS 446-52-6
Molecular Weight (g/mol) 124.114
MDL Number MFCD00003302
SMILES C1=CC=C(C(=C1)C=O)F
Synonym o-fluorobenzaldehyde,benzaldehyde, 2-fluoro,benzaldehyde, o-fluoro,unii-7zx20dxb9z,2-fluor-benzaldehyd,2-fluoro-benzaldehyde,benzaldehyde, fluoro,ortho-fluorobenzaldehyde,7zx20dxb9z,fluorobenzaldehyde
IUPAC Name 2-fluorobenzaldehyde
InChI Key ZWDVQMVZZYIAHO-UHFFFAOYSA-N
Molecular Formula C7H5FO
3

2,6-Difluorobenzonitrile 99.0+%, TCI America™

CAS: 1897-52-5 Molecular Formula: C7H3F2N Molecular Weight (g/mol): 139.105 MDL Number: MFCD00001778 InChI Key: BNBRIFIJRKJGEI-UHFFFAOYSA-N Synonym: 2,6-difluorobenznitrile,benzonitrile, 2,6-difluoro,2,6-difluoro-benzonitrile,2,6-dfbn,unii-1j58z42a2e,2,6-difluoro benzonitrile,2,6-difluorobenzenecarbonitrile,2,6-difluorophenylcyanide,ncr bf ff,6-difluorobenzonitrile PubChem CID: 74695 IUPAC Name: 2,6-difluorobenzonitrile SMILES: C1=CC(=C(C(=C1)F)C#N)F

PubChem CID 74695
CAS 1897-52-5
Molecular Weight (g/mol) 139.105
MDL Number MFCD00001778
SMILES C1=CC(=C(C(=C1)F)C#N)F
Synonym 2,6-difluorobenznitrile,benzonitrile, 2,6-difluoro,2,6-difluoro-benzonitrile,2,6-dfbn,unii-1j58z42a2e,2,6-difluoro benzonitrile,2,6-difluorobenzenecarbonitrile,2,6-difluorophenylcyanide,ncr bf ff,6-difluorobenzonitrile
IUPAC Name 2,6-difluorobenzonitrile
InChI Key BNBRIFIJRKJGEI-UHFFFAOYSA-N
Molecular Formula C7H3F2N
4

4-Dimethylaminobenzylamine Dihydrochloride 98.0+%, TCI America™

CAS: 34403-52-6 Molecular Formula: C9H15N2 Molecular Weight (g/mol): 151.23 MDL Number: MFCD00012862 InChI Key: PDJZOFLRRJQYBF-UHFFFAOYSA-O PubChem CID: 2734633 IUPAC Name: [4-(dimethylamino)phenyl]methanaminium SMILES: CN(C)C1=CC=C(C[NH3+])C=C1

PubChem CID 2734633
CAS 34403-52-6
Molecular Weight (g/mol) 151.23
MDL Number MFCD00012862
SMILES CN(C)C1=CC=C(C[NH3+])C=C1
IUPAC Name [4-(dimethylamino)phenyl]methanaminium
InChI Key PDJZOFLRRJQYBF-UHFFFAOYSA-O
Molecular Formula C9H15N2
5

1,4-Dibromo-2-iodobenzene 98.0+%, TCI America™

CAS: 89284-52-6 Molecular Formula: C6H3Br2I Molecular Weight (g/mol): 361.802 MDL Number: MFCD07778993 InChI Key: VLRYPRKTXDPVNN-UHFFFAOYSA-N PubChem CID: 13406348 IUPAC Name: 1,4-dibromo-2-iodobenzene SMILES: C1=CC(=C(C=C1Br)I)Br

PubChem CID 13406348
CAS 89284-52-6
Molecular Weight (g/mol) 361.802
MDL Number MFCD07778993
SMILES C1=CC(=C(C=C1Br)I)Br
IUPAC Name 1,4-dibromo-2-iodobenzene
InChI Key VLRYPRKTXDPVNN-UHFFFAOYSA-N
Molecular Formula C6H3Br2I
6

3-Bromo-2,4,6-trimethylaniline 98.0+%, TCI America™

CAS: 82842-52-2 Molecular Formula: C9H12BrN Molecular Weight (g/mol): 214.106 MDL Number: MFCD00015476 InChI Key: MVLMPTBHZPYDBZ-UHFFFAOYSA-N Synonym: benzenamine, 3-bromo-2,4,6-trimethyl,pubchem4363,ksc496e8h,2,4,6-trimethyl-3-bromoaniline,3-bromo-2,4,6-trimethyl-aniline,3-bromo-2,4,6-trimethylbenzenamine,3-bromo-2,4,6-trimethylphenylamine,3-bromo-2,4,6-trimethyl-phenylamine,3-bromo-2,4,6-trimethylaniline,3-bromo-2,4,6-trimethylaniline, 98+% PubChem CID: 688300 IUPAC Name: 3-bromo-2,4,6-trimethylaniline SMILES: CC1=CC(=C(C(=C1N)C)Br)C

PubChem CID 688300
CAS 82842-52-2
Molecular Weight (g/mol) 214.106
MDL Number MFCD00015476
SMILES CC1=CC(=C(C(=C1N)C)Br)C
Synonym benzenamine, 3-bromo-2,4,6-trimethyl,pubchem4363,ksc496e8h,2,4,6-trimethyl-3-bromoaniline,3-bromo-2,4,6-trimethyl-aniline,3-bromo-2,4,6-trimethylbenzenamine,3-bromo-2,4,6-trimethylphenylamine,3-bromo-2,4,6-trimethyl-phenylamine,3-bromo-2,4,6-trimethylaniline,3-bromo-2,4,6-trimethylaniline, 98+%
IUPAC Name 3-bromo-2,4,6-trimethylaniline
InChI Key MVLMPTBHZPYDBZ-UHFFFAOYSA-N
Molecular Formula C9H12BrN
7

1-Bromo-2,4,5-trifluorobenzene 98.0+%, TCI America™

CAS: 327-52-6 Molecular Formula: C6H2BrF3 Molecular Weight (g/mol): 210.981 MDL Number: MFCD00000306 InChI Key: DVTULTINXNWGJY-UHFFFAOYSA-N Synonym: 2,4,5-trifluorobromobenzene,2-bromo-1,4,5-trifluorobenzene,benzene, 1-bromo-2,4,5-trifluoro,1-bromo-2,4,5-trifluoro-benzene,paragos 390205,5-bromo-1,2,4-trifluorobenzene,fr bf df ee,pubchem2306,acmc-1cs6j,ksc224g3h PubChem CID: 67597 IUPAC Name: 1-bromo-2,4,5-trifluorobenzene SMILES: C1=C(C(=CC(=C1F)Br)F)F

PubChem CID 67597
CAS 327-52-6
Molecular Weight (g/mol) 210.981
MDL Number MFCD00000306
SMILES C1=C(C(=CC(=C1F)Br)F)F
Synonym 2,4,5-trifluorobromobenzene,2-bromo-1,4,5-trifluorobenzene,benzene, 1-bromo-2,4,5-trifluoro,1-bromo-2,4,5-trifluoro-benzene,paragos 390205,5-bromo-1,2,4-trifluorobenzene,fr bf df ee,pubchem2306,acmc-1cs6j,ksc224g3h
IUPAC Name 1-bromo-2,4,5-trifluorobenzene
InChI Key DVTULTINXNWGJY-UHFFFAOYSA-N
Molecular Formula C6H2BrF3
8

2-Methyl-5-nitrobenzoic Acid 98.0+%, TCI America™

CAS: 1975-52-6 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.147 MDL Number: MFCD00007371 InChI Key: DJRFJAVPROZZFL-UHFFFAOYSA-N Synonym: 2-methyl-5-nitrobenzoic acid,5-nitro-o-toluic acid,benzoic acid, 2-methyl-5-nitro,2-methyl-5-nitro-benzoic acid,5-nitro-2-methylbenzoic acid,rarechem al bo 0285,5-nitro-2-methyl benzoic acid,2-methyl-5-nitro benzoic acid,pubchem2244 PubChem CID: 519683 SMILES: CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O

PubChem CID 519683
CAS 1975-52-6
Molecular Weight (g/mol) 181.147
MDL Number MFCD00007371
SMILES CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O
Synonym 2-methyl-5-nitrobenzoic acid,5-nitro-o-toluic acid,benzoic acid, 2-methyl-5-nitro,2-methyl-5-nitro-benzoic acid,5-nitro-2-methylbenzoic acid,rarechem al bo 0285,5-nitro-2-methyl benzoic acid,2-methyl-5-nitro benzoic acid,pubchem2244
InChI Key DJRFJAVPROZZFL-UHFFFAOYSA-N
Molecular Formula C8H7NO4
9

4-Bromo-2,6-di-tert-butylphenol 98.0+%, TCI America™

CAS: 1139-52-2 Molecular Formula: C14H21BrO Molecular Weight (g/mol): 285.225 MDL Number: MFCD00051598 InChI Key: SSQQUEKFNSJLKX-UHFFFAOYSA-N Synonym: 4-bromo-2,6-di-tert-butylphenol,2,6-di-tert-butyl-4-bromophenol,4-bromo-2,6-di-t-butylphenol,phenol, 4-bromo-2,6-bis 1,1-dimethylethyl,2,6-bis tert-butyl-4-bromophenol,4-bromo-2,6-di tert-butyl phenol,4-bromo-2,6-di-tert-butyl phenol,4-bromo-2,6-bis 1,1-dimethylethyl phenol,phenol, 4-bromo-2,6-di-tert-butyl,acmc-1c5t6 PubChem CID: 70829 IUPAC Name: 4-bromo-2,6-ditert-butylphenol SMILES: CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)Br

PubChem CID 70829
CAS 1139-52-2
Molecular Weight (g/mol) 285.225
MDL Number MFCD00051598
SMILES CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)Br
Synonym 4-bromo-2,6-di-tert-butylphenol,2,6-di-tert-butyl-4-bromophenol,4-bromo-2,6-di-t-butylphenol,phenol, 4-bromo-2,6-bis 1,1-dimethylethyl,2,6-bis tert-butyl-4-bromophenol,4-bromo-2,6-di tert-butyl phenol,4-bromo-2,6-di-tert-butyl phenol,4-bromo-2,6-bis 1,1-dimethylethyl phenol,phenol, 4-bromo-2,6-di-tert-butyl,acmc-1c5t6
IUPAC Name 4-bromo-2,6-ditert-butylphenol
InChI Key SSQQUEKFNSJLKX-UHFFFAOYSA-N
Molecular Formula C14H21BrO
10

Methyl 2-Iodo-5-methylbenzoate 98.0+%, TCI America™

CAS: 103440-52-4 Molecular Formula: C9H9IO2 Molecular Weight (g/mol): 276.07 MDL Number: MFCD12198129 InChI Key: DHYMLHOXGMUIDZ-UHFFFAOYSA-N PubChem CID: 14263946 IUPAC Name: methyl 2-iodo-5-methylbenzoate SMILES: COC(=O)C1=C(I)C=CC(C)=C1

PubChem CID 14263946
CAS 103440-52-4
Molecular Weight (g/mol) 276.07
MDL Number MFCD12198129
SMILES COC(=O)C1=C(I)C=CC(C)=C1
IUPAC Name methyl 2-iodo-5-methylbenzoate
InChI Key DHYMLHOXGMUIDZ-UHFFFAOYSA-N
Molecular Formula C9H9IO2
11

nitro-Grela 97.0+%, TCI America™

CAS: 502964-52-5 Molecular Formula: C31H37Cl2N3O3Ru MDL Number: MFCD28411645 Synonym: [1,3-Bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro[(2-isopropoxy-5-nitrobenzylidene)]ruthenium(VI)

CAS 502964-52-5
MDL Number MFCD28411645
Synonym [1,3-Bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro[(2-isopropoxy-5-nitrobenzylidene)]ruthenium(VI)
Molecular Formula C31H37Cl2N3O3Ru
12

Medchemexpress LLC Nifuroxazide (standard) | 965-52-6 | 10 G
SDP

Nifuroxazide is an orally active nitrofuran antibiotic that effectively inhibits STAT3, exhibiting potent anti-tumor and anti-metastasis activities.

  • Effective inhibitor of STAT3.
  • Exhibits potent anti-tumor and anti-metastasis activity.
  • Inhibits STAT3 tyrosine phosphorylation in U266 cells.
  • Causes dose-dependent loss of cell viability in U266 or INA6 cells.
  • Inhibits tumor growth and weight in mice.
  • Inhibits proliferation of Ki-67-positive cells and induces apoptosis.
  • Inhibits expression of MMP-2, MMP-9, and p-Stat3 in A375 tumor tissues.
  • Suppresses distant colonization of tumor cells in melanoma metastasis models by inhibiting MDSCs infiltration into the lung.

ENCOMPASS_PREFERRED
13

Medchemexpress LLC Amino-PEG16-acid | 2922656-52-6 | 95.0% | C35H71NO18 | 25MG
SDP

Amino-PEG16-acid is a PEG-based PROTAC linker designed for the synthesis of PROTACs. PROTACs are molecules that utilize a linker to connect two ligands: one for an E3 ubiquitin ligase and another for a target protein, enabling the selective degradation of target proteins via the intracellular ubiquitin-proteasome system.

  • PEG-based linker for PROTAC synthesis.
  • Enables selective degradation of target proteins.
  • Utilizes the intracellular ubiquitin-proteasome system.
  • Solid appearance, white to off-white color.
  • For research use only.

ENCOMPASS_PREFERRED
14

Medchemexpress LLC m-PEG16-COOH | 2933174-52-6 | 98.0% | 764.89 | 25 MG
SDP

m-PEG16-COOH is a PEG-based PROTAC linker utilized in the synthesis of PROTACs. This product is intended for research use only.

  • PEG-based PROTAC linker
  • Utilized in the synthesis of PROTACs
  • Supports PROTACs containing two different ligands connected by a linker
  • Enables exploitation of the intracellular ubiquitin-proteasome system to selectively degrade target proteins

ENCOMPASS_PREFERRED
15

Medchemexpress LLC M-PEG16-COOH | 2933174-52-6 | 98.0% | 764.89 | 50 MG
SDP

m-PEG16-COOH is a PEG-based PROTAC linker utilized in the synthesis of PROTACs. PROTACs contain two different ligands connected by a linker; one is for an E3 ubiquitin ligase and the other for the target protein. They exploit the intracellular ubiquitin-proteasome system to selectively degrade target proteins. This product is for research use only.

  • PEG-based PROTAC linker
  • Used in the synthesis of PROTACs
  • Exploits intracellular ubiquitin-proteasome system
  • Selectively degrades target proteins
  • For research use only

ENCOMPASS_PREFERRED