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Benzenoids

Organic compounds that are derived from or have a benzene group in their molecular structure. Benzene is an aromatic organic molecule composed of 6 carbon atoms and 6 hydrogen atoms that form a ring. Includes derivatives and substituted molecules.
Benzene and substituted derivatives (91,111)
Phenols (18,216)
Naphthalenes (5,660)
Phenol esters (2,133)
Fluorenes (1,268)
Unsubstituted Phenols (1,255)
Thiophenols (626)
Anthracenes (491)
Indanes (399)
Phenanthrenes and derivatives (359)
Tetralins (338)
Triphenyl compounds (276)
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Ellagic acids and derivatives (33)
Pentacenes (20)
Acenaphthylenes (16)
Pentacenequinones (16)
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1-hydroxylamino 2-unsubstituted benzenoids (5)

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10,831 – 10,845 of 109,301 results
10,831

4-Fluoro-3-nitrobenzaldehyde 95.0+%, TCI America™

CAS: 42564-51-2 Molecular Formula: C7H4FNO3 Molecular Weight (g/mol): 169.111 MDL Number: MFCD01861388 InChI Key: ILKWFRCNNILIJW-UHFFFAOYSA-N Synonym: 3-nitro-4-fluorobenzaldehyde,benzaldehyde, 4-fluoro-3-nitro,4-fluoro-3-nitro-benzaldehyde,pubchem22572,acmc-1ao2q,3-nitro-4 fluorobenzaldehyde,ksc497m9r,2-fluoro-5-formylnitrobenzene,#,4-fluoranyl-3-nitro-benzaldehyde PubChem CID: 598129 IUPAC Name: 4-fluoro-3-nitrobenzaldehyde SMILES: C1=CC(=C(C=C1C=O)[N+](=O)[O-])F

PubChem CID 598129
CAS 42564-51-2
Molecular Weight (g/mol) 169.111
MDL Number MFCD01861388
SMILES C1=CC(=C(C=C1C=O)[N+](=O)[O-])F
Synonym 3-nitro-4-fluorobenzaldehyde,benzaldehyde, 4-fluoro-3-nitro,4-fluoro-3-nitro-benzaldehyde,pubchem22572,acmc-1ao2q,3-nitro-4 fluorobenzaldehyde,ksc497m9r,2-fluoro-5-formylnitrobenzene,#,4-fluoranyl-3-nitro-benzaldehyde
IUPAC Name 4-fluoro-3-nitrobenzaldehyde
InChI Key ILKWFRCNNILIJW-UHFFFAOYSA-N
Molecular Formula C7H4FNO3
10,832

2-Methoxy-4-nitrotoluene 98.0+%, TCI America™

CAS: 13120-77-9 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.16 MDL Number: MFCD00043912 InChI Key: WVQGZNRUEVFXKR-UHFFFAOYSA-N Synonym: 1-Methoxy-2-methyl-5-nitrobenzene, 2-Methyl-5-nitroanisole PubChem CID: 83159 IUPAC Name: 2-methoxy-1-methyl-4-nitrobenzene SMILES: COC1=CC(=CC=C1C)[N+]([O-])=O

PubChem CID 83159
CAS 13120-77-9
Molecular Weight (g/mol) 167.16
MDL Number MFCD00043912
SMILES COC1=CC(=CC=C1C)[N+]([O-])=O
Synonym 1-Methoxy-2-methyl-5-nitrobenzene, 2-Methyl-5-nitroanisole
IUPAC Name 2-methoxy-1-methyl-4-nitrobenzene
InChI Key WVQGZNRUEVFXKR-UHFFFAOYSA-N
Molecular Formula C8H9NO3
10,833

4-Nitroanisole 98.0+%, TCI America™

CAS: 100-17-4 Molecular Formula: C7H7NO3 Molecular Weight (g/mol): 153.14 MDL Number: MFCD00007327 InChI Key: BNUHAJGCKIQFGE-UHFFFAOYSA-N Synonym: 4-nitroanisole,p-nitroanisole,4-methoxynitrobenzene,p-methoxynitrobenzene,benzene, 1-methoxy-4-nitro,nitroanisole,p-nitroanisol,anisole, p-nitro,4-nitrophenyl methyl ether,unii-g989z7wolh PubChem CID: 7485 ChEBI: CHEBI:1911 IUPAC Name: 1-methoxy-4-nitrobenzene SMILES: COC1=CC=C(C=C1)[N+]([O-])=O

PubChem CID 7485
CAS 100-17-4
Molecular Weight (g/mol) 153.14
ChEBI CHEBI:1911
MDL Number MFCD00007327
SMILES COC1=CC=C(C=C1)[N+]([O-])=O
Synonym 4-nitroanisole,p-nitroanisole,4-methoxynitrobenzene,p-methoxynitrobenzene,benzene, 1-methoxy-4-nitro,nitroanisole,p-nitroanisol,anisole, p-nitro,4-nitrophenyl methyl ether,unii-g989z7wolh
IUPAC Name 1-methoxy-4-nitrobenzene
InChI Key BNUHAJGCKIQFGE-UHFFFAOYSA-N
Molecular Formula C7H7NO3
10,834

4,5-Bis(benzoylthio)-1,3-dithiole-2-thione 98.0+%, TCI America™

CAS: 68494-08-6 Molecular Formula: C17H10O2S5 Molecular Weight (g/mol): 406.565 MDL Number: MFCD00059894 InChI Key: YQZPSSPUVUGQQS-UHFFFAOYSA-N PubChem CID: 364673 IUPAC Name: S-(5-benzoylsulfanyl-2-sulfanylidene-1,3-dithiol-4-yl) benzenecarbothioate SMILES: C1=CC=C(C=C1)C(=O)SC2=C(SC(=S)S2)SC(=O)C3=CC=CC=C3

PubChem CID 364673
CAS 68494-08-6
Molecular Weight (g/mol) 406.565
MDL Number MFCD00059894
SMILES C1=CC=C(C=C1)C(=O)SC2=C(SC(=S)S2)SC(=O)C3=CC=CC=C3
IUPAC Name S-(5-benzoylsulfanyl-2-sulfanylidene-1,3-dithiol-4-yl) benzenecarbothioate
InChI Key YQZPSSPUVUGQQS-UHFFFAOYSA-N
Molecular Formula C17H10O2S5
10,835

Benzoylthiocholine Iodide 98.0+%, TCI America™

CAS: 10561-14-5 Molecular Formula: C12H18INOS Molecular Weight (g/mol): 351.25 MDL Number: MFCD00059970 InChI Key: PCGVSJGEHWZOBK-UHFFFAOYSA-M PubChem CID: 13960252 IUPAC Name: [2-(benzoylsulfanyl)ethyl]trimethylazanium iodide SMILES: [I-].C[N+](C)(C)CCSC(=O)C1=CC=CC=C1

PubChem CID 13960252
CAS 10561-14-5
Molecular Weight (g/mol) 351.25
MDL Number MFCD00059970
SMILES [I-].C[N+](C)(C)CCSC(=O)C1=CC=CC=C1
IUPAC Name [2-(benzoylsulfanyl)ethyl]trimethylazanium iodide
InChI Key PCGVSJGEHWZOBK-UHFFFAOYSA-M
Molecular Formula C12H18INOS
10,836

alpha,alpha'-Dibromo-m-xylene 97.0+%, TCI America™

CAS: 626-15-3 Molecular Formula: C8H8Br2 Molecular Weight (g/mol): 263.96 MDL Number: MFCD00000178 InChI Key: OXHOPZLBSSTTBU-UHFFFAOYSA-N Synonym: 1,3-bis bromomethyl benzene,m-xylylene dibromide,alpha,alpha'-dibromo-m-xylene,benzene, 1,3-bis bromomethyl,m-bis bromomethyl benzene,m-xylylene bromide,ccris 1777,m-xylyene dibromide,m-xylene, .alpha.,.alpha.'-dibromo,m-.alpha.,.alpha.'-dibromoxylene PubChem CID: 69373 IUPAC Name: 1,3-bis(bromomethyl)benzene SMILES: C1=CC(=CC(=C1)CBr)CBr

PubChem CID 69373
CAS 626-15-3
Molecular Weight (g/mol) 263.96
MDL Number MFCD00000178
SMILES C1=CC(=CC(=C1)CBr)CBr
Synonym 1,3-bis bromomethyl benzene,m-xylylene dibromide,alpha,alpha'-dibromo-m-xylene,benzene, 1,3-bis bromomethyl,m-bis bromomethyl benzene,m-xylylene bromide,ccris 1777,m-xylyene dibromide,m-xylene, .alpha.,.alpha.'-dibromo,m-.alpha.,.alpha.'-dibromoxylene
IUPAC Name 1,3-bis(bromomethyl)benzene
InChI Key OXHOPZLBSSTTBU-UHFFFAOYSA-N
Molecular Formula C8H8Br2
10,837

2-Chloro-5-fluorobenzyl Bromide 96.0+%, TCI America™

CAS: 81778-09-8 Molecular Formula: C7H5BrClF Molecular Weight (g/mol): 223.469 MDL Number: MFCD01631419 InChI Key: AUVLFQDKJFSFIX-UHFFFAOYSA-N Synonym: 2-chloro-5-fluorobenzyl bromide,2-bromomethyl-1-chloro-4-fluorobenzene,2-chloro-5-fluorobenzylbromide,1-bromomethyl-2-chloro-5-fluorobenzene,pubchem7498,acmc-1blqd,2-bromomethyl-1-chloro-4-fluoro-benzene,2-chloro5-fluorobenzyl bromide,2-chloro-5-fluoro-benzylbromide,2-chloro-5-fluoro-benzyl bromide PubChem CID: 2773623 IUPAC Name: 2-(bromomethyl)-1-chloro-4-fluorobenzene SMILES: C1=CC(=C(C=C1F)CBr)Cl

PubChem CID 2773623
CAS 81778-09-8
Molecular Weight (g/mol) 223.469
MDL Number MFCD01631419
SMILES C1=CC(=C(C=C1F)CBr)Cl
Synonym 2-chloro-5-fluorobenzyl bromide,2-bromomethyl-1-chloro-4-fluorobenzene,2-chloro-5-fluorobenzylbromide,1-bromomethyl-2-chloro-5-fluorobenzene,pubchem7498,acmc-1blqd,2-bromomethyl-1-chloro-4-fluoro-benzene,2-chloro5-fluorobenzyl bromide,2-chloro-5-fluoro-benzylbromide,2-chloro-5-fluoro-benzyl bromide
IUPAC Name 2-(bromomethyl)-1-chloro-4-fluorobenzene
InChI Key AUVLFQDKJFSFIX-UHFFFAOYSA-N
Molecular Formula C7H5BrClF
10,838

Hexakis(bromomethyl)benzene 98.0+%, TCI America™

CAS: 3095-73-6 Molecular Formula: C12H12Br6 Molecular Weight (g/mol): 635.652 MDL Number: MFCD00182539 InChI Key: XJOUCILNLRXRTF-UHFFFAOYSA-N Synonym: hexakis bromomethyl benzene,hexa bromomethyl benzene,1,2,3,4,5,6-hexakis bromomethyl benzene,benzene, hexakis bromomethyl,acmc-1aijn,10.14272/xjoucilnlrxrtf-uhfffaoysa-n,benzene,1,2,3,4,5,6-hexakis bromomethyl,doi:10.14272/xjoucilnlrxrtf-uhfffaoysa-n PubChem CID: 76540 IUPAC Name: 1,2,3,4,5,6-hexakis(bromomethyl)benzene SMILES: C(C1=C(C(=C(C(=C1CBr)CBr)CBr)CBr)CBr)Br

PubChem CID 76540
CAS 3095-73-6
Molecular Weight (g/mol) 635.652
MDL Number MFCD00182539
SMILES C(C1=C(C(=C(C(=C1CBr)CBr)CBr)CBr)CBr)Br
Synonym hexakis bromomethyl benzene,hexa bromomethyl benzene,1,2,3,4,5,6-hexakis bromomethyl benzene,benzene, hexakis bromomethyl,acmc-1aijn,10.14272/xjoucilnlrxrtf-uhfffaoysa-n,benzene,1,2,3,4,5,6-hexakis bromomethyl,doi:10.14272/xjoucilnlrxrtf-uhfffaoysa-n
IUPAC Name 1,2,3,4,5,6-hexakis(bromomethyl)benzene
InChI Key XJOUCILNLRXRTF-UHFFFAOYSA-N
Molecular Formula C12H12Br6
10,839

alpha-Chloro-m-xylene 97.0+%, TCI America™

CAS: 620-19-9 Molecular Formula: C8H9Cl Molecular Weight (g/mol): 140.61 MDL Number: MFCD00000909 InChI Key: LZBOHNCMCCSTJX-UHFFFAOYSA-N Synonym: 3-methylbenzyl chloride,1-chloromethyl-3-methylbenzene,m-xylyl chloride,3-methylbenzylchloride,alpha-chloro-m-xylene,m-methylbenzyl chloride,1-chloromethyl-3-methyl-benzene,m-chloromethyl toluene,3-chloromethyl toluene,benzene, 1-chloromethyl-3-methyl PubChem CID: 12102 IUPAC Name: 1-(chloromethyl)-3-methylbenzene SMILES: CC1=CC(=CC=C1)CCl

PubChem CID 12102
CAS 620-19-9
Molecular Weight (g/mol) 140.61
MDL Number MFCD00000909
SMILES CC1=CC(=CC=C1)CCl
Synonym 3-methylbenzyl chloride,1-chloromethyl-3-methylbenzene,m-xylyl chloride,3-methylbenzylchloride,alpha-chloro-m-xylene,m-methylbenzyl chloride,1-chloromethyl-3-methyl-benzene,m-chloromethyl toluene,3-chloromethyl toluene,benzene, 1-chloromethyl-3-methyl
IUPAC Name 1-(chloromethyl)-3-methylbenzene
InChI Key LZBOHNCMCCSTJX-UHFFFAOYSA-N
Molecular Formula C8H9Cl
10,840

2-Bromo-4-nitrophenol 98.0+%, TCI America™

CAS: 5847-59-6 Molecular Formula: C6H4BrNO3 Molecular Weight (g/mol): 218.006 MDL Number: MFCD06656567 InChI Key: DCIPFSYBGTWYCR-UHFFFAOYSA-N Synonym: 3-Bromo-4-hydroxynitrobenzene PubChem CID: 22109 SMILES: C1=CC(=C(C=C1[N+](=O)[O-])Br)O

PubChem CID 22109
CAS 5847-59-6
Molecular Weight (g/mol) 218.006
MDL Number MFCD06656567
SMILES C1=CC(=C(C=C1[N+](=O)[O-])Br)O
Synonym 3-Bromo-4-hydroxynitrobenzene
InChI Key DCIPFSYBGTWYCR-UHFFFAOYSA-N
Molecular Formula C6H4BrNO3
10,841

6-Bromo-2-hydroxy-3-methoxybenzaldehyde 99.0+%, TCI America™

CAS: 20035-41-0 Molecular Formula: C8H7BrO3 Molecular Weight (g/mol): 231.05 MDL Number: MFCD00046152 InChI Key: JUPJZUTYDWXZAQ-UHFFFAOYSA-N PubChem CID: 262237 IUPAC Name: 6-bromo-2-hydroxy-3-methoxybenzaldehyde SMILES: COC1=CC=C(Br)C(C=O)=C1O

PubChem CID 262237
CAS 20035-41-0
Molecular Weight (g/mol) 231.05
MDL Number MFCD00046152
SMILES COC1=CC=C(Br)C(C=O)=C1O
IUPAC Name 6-bromo-2-hydroxy-3-methoxybenzaldehyde
InChI Key JUPJZUTYDWXZAQ-UHFFFAOYSA-N
Molecular Formula C8H7BrO3
10,842

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

CAS: 98130-56-4 Molecular Formula: C6H3BrF2O Molecular Weight (g/mol): 208.99 MDL Number: MFCD00070752 InChI Key: YDRZYJATKMBSJX-UHFFFAOYSA-N Synonym: 2-bromo-4,6-difluoro-phenol,buttpark 20\04-78,phenol, 2-bromo-4,6-difluoro,pubchem2836,acmc-209s9n,2-bromo-4,6-difluorophenol,2-bromanyl-4,6-bis fluoranyl phenol,2-bromo-4,6-difluorophenol, 98+% PubChem CID: 2736290 IUPAC Name: 2-bromo-4,6-difluorophenol SMILES: C1=C(C=C(C(=C1F)O)Br)F

PubChem CID 2736290
CAS 98130-56-4
Molecular Weight (g/mol) 208.99
MDL Number MFCD00070752
SMILES C1=C(C=C(C(=C1F)O)Br)F
Synonym 2-bromo-4,6-difluoro-phenol,buttpark 20\04-78,phenol, 2-bromo-4,6-difluoro,pubchem2836,acmc-209s9n,2-bromo-4,6-difluorophenol,2-bromanyl-4,6-bis fluoranyl phenol,2-bromo-4,6-difluorophenol, 98+%
IUPAC Name 2-bromo-4,6-difluorophenol
InChI Key YDRZYJATKMBSJX-UHFFFAOYSA-N
Molecular Formula C6H3BrF2O
10,843

3-Fluoro-5-hydroxyphenylboronic Acid (contains varying amounts of Anhydride), TCI America™

CAS: 871329-82-7 Molecular Formula: C6H6BFO3 Molecular Weight (g/mol): 155.919 MDL Number: MFCD07363778 InChI Key: RMBFBZIEXCTPDB-UHFFFAOYSA-N Synonym: 3-fluoro-5-hydroxyphenyl boronic acid,3-fluoro-5-hydroxybenzeneboronic acid,3-fluoro-5-hydroxy-phenyl boronic acid,3-fluoro-5-hydroxphenyl boronic acid,3-hydroxyl-5-fluoro-phenyl-boronic acid,acmc-209qgp,3-fluoro-5-hydroxyphenyl-boronic acid,3-fluoranyl-5-oxidanyl-phenyl boronic acid,boronic acid,b-3-fluoro-5-hydroxyphenyl PubChem CID: 44717308 IUPAC Name: (3-fluoro-5-hydroxyphenyl)boronic acid SMILES: B(C1=CC(=CC(=C1)F)O)(O)O

PubChem CID 44717308
CAS 871329-82-7
Molecular Weight (g/mol) 155.919
MDL Number MFCD07363778
SMILES B(C1=CC(=CC(=C1)F)O)(O)O
Synonym 3-fluoro-5-hydroxyphenyl boronic acid,3-fluoro-5-hydroxybenzeneboronic acid,3-fluoro-5-hydroxy-phenyl boronic acid,3-fluoro-5-hydroxphenyl boronic acid,3-hydroxyl-5-fluoro-phenyl-boronic acid,acmc-209qgp,3-fluoro-5-hydroxyphenyl-boronic acid,3-fluoranyl-5-oxidanyl-phenyl boronic acid,boronic acid,b-3-fluoro-5-hydroxyphenyl
IUPAC Name (3-fluoro-5-hydroxyphenyl)boronic acid
InChI Key RMBFBZIEXCTPDB-UHFFFAOYSA-N
Molecular Formula C6H6BFO3
10,844

Pentaethylene Glycol Monobenzyl Ether 95.0+%, TCI America™

CAS: 57671-28-0 Molecular Formula: C17H28O6 Molecular Weight (g/mol): 328.405 MDL Number: MFCD06797154 InChI Key: UMUSOTNGYAALST-UHFFFAOYSA-N Synonym: 2-[2-[2-[2-[2-(Benzyloxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol PubChem CID: 13553692 IUPAC Name: 2-[2-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethoxy]ethoxy]ethanol SMILES: C1=CC=C(C=C1)COCCOCCOCCOCCOCCO

PubChem CID 13553692
CAS 57671-28-0
Molecular Weight (g/mol) 328.405
MDL Number MFCD06797154
SMILES C1=CC=C(C=C1)COCCOCCOCCOCCOCCO
Synonym 2-[2-[2-[2-[2-(Benzyloxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol
IUPAC Name 2-[2-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethoxy]ethoxy]ethanol
InChI Key UMUSOTNGYAALST-UHFFFAOYSA-N
Molecular Formula C17H28O6
10,845

3-Methylbenzyl Alcohol 98.0+%, TCI America™

CAS: 587-03-1 Molecular Formula: C8H10O Molecular Weight (g/mol): 122.167 MDL Number: MFCD00004646 InChI Key: JJCKHVUTVOPLBV-UHFFFAOYSA-N Synonym: 3-methylbenzyl alcohol,3-methylphenyl methanol,m-tolyl carbinol,m-tolylmethanol,benzenemethanol, 3-methyl,unii-ttg38p37u6,m-methylbenzyl alcohol,3-methylbenzylalcohol,m-methyl benzyl alcohol,3-methyl-benzenemethanol PubChem CID: 11476 ChEBI: CHEBI:27995 IUPAC Name: (3-methylphenyl)methanol SMILES: CC1=CC(=CC=C1)CO

PubChem CID 11476
CAS 587-03-1
Molecular Weight (g/mol) 122.167
ChEBI CHEBI:27995
MDL Number MFCD00004646
SMILES CC1=CC(=CC=C1)CO
Synonym 3-methylbenzyl alcohol,3-methylphenyl methanol,m-tolyl carbinol,m-tolylmethanol,benzenemethanol, 3-methyl,unii-ttg38p37u6,m-methylbenzyl alcohol,3-methylbenzylalcohol,m-methyl benzyl alcohol,3-methyl-benzenemethanol
IUPAC Name (3-methylphenyl)methanol
InChI Key JJCKHVUTVOPLBV-UHFFFAOYSA-N
Molecular Formula C8H10O