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.

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586 – 600 of 78,418 results

586

Salicylamide, 99%

CAS: 65-45-2 Molecular Formula: C7H7NO2 Molecular Weight (g/mol): 137.14 MDL Number: MFCD00007978 InChI Key: SKZKKFZAGNVIMN-UHFFFAOYSA-N Synonym: salicylamide,o-hydroxybenzamide,benzamide, 2-hydroxy,salicylic acid amide,2-carbamoylphenol,flarpirina,morsarinas,algamon,algiamida,allevin PubChem CID: 5147 ChEBI: CHEBI:32114 IUPAC Name: 2-hydroxybenzamide SMILES: NC(=O)C1=CC=CC=C1O

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Specifications

PubChem CID	5147
CAS	65-45-2
Molecular Weight (g/mol)	137.14
ChEBI	CHEBI:32114
MDL Number	MFCD00007978
SMILES	NC(=O)C1=CC=CC=C1O
Synonym	salicylamide,o-hydroxybenzamide,benzamide, 2-hydroxy,salicylic acid amide,2-carbamoylphenol,flarpirina,morsarinas,algamon,algiamida,allevin
IUPAC Name	2-hydroxybenzamide
InChI Key	SKZKKFZAGNVIMN-UHFFFAOYSA-N
Molecular Formula	C7H7NO2

587

Dithizone, ACS, 85+%

CAS: 60-10-6 Molecular Formula: C13H12N4S Molecular Weight (g/mol): 256.33 MDL Number: MFCD00003025 InChI Key: UOFGSWVZMUXXIY-UHFFFAOYSA-N Synonym: dithizone,dithizon,ditizon,carbazone, diphenylthio,usaf ek-3092,diazenecarbothioic acid, phenyl-, 2-phenylhydrazide,1,5-diphenyl-3-mercaptoformazan,3-formazanthiol, 1,5-diphenyl,unii-njz2cj4d6p,1,5-diphenyl-3-thiocarbazone PubChem CID: 657262 IUPAC Name: 1-anilino-3-phenyliminothiourea SMILES: S=C(NNC1=CC=CC=C1)N=NC1=CC=CC=C1

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Specifications

PubChem CID	657262
CAS	60-10-6
Molecular Weight (g/mol)	256.33
MDL Number	MFCD00003025
SMILES	S=C(NNC1=CC=CC=C1)N=NC1=CC=CC=C1
Synonym	dithizone,dithizon,ditizon,carbazone, diphenylthio,usaf ek-3092,diazenecarbothioic acid, phenyl-, 2-phenylhydrazide,1,5-diphenyl-3-mercaptoformazan,3-formazanthiol, 1,5-diphenyl,unii-njz2cj4d6p,1,5-diphenyl-3-thiocarbazone
IUPAC Name	1-anilino-3-phenyliminothiourea
InChI Key	UOFGSWVZMUXXIY-UHFFFAOYSA-N
Molecular Formula	C13H12N4S

588

Niclosamide, 97+%, Thermo Scientific Chemicals

CAS: 50-65-7 Molecular Formula: C13H8Cl2N2O4 Molecular Weight (g/mol): 327.12 MDL Number: MFCD00057597 InChI Key: RJMUSRYZPJIFPJ-UHFFFAOYSA-N Synonym: niclosamide,5-chloro-n-2-chloro-4-nitrophenyl-2-hydroxybenzamide,niclocide,bayluscid,phenasal,tredemine,fenasal,yomesan,dichlosale,helmiantin PubChem CID: 4477 IUPAC Name: 5-chloro-N-(2-chloro-4-nitrophenyl)-2-hydroxybenzamide SMILES: OC1=CC=C(Cl)C=C1C(=O)NC1=CC=C(C=C1Cl)[N+]([O-])=O

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Specifications

PubChem CID	4477
CAS	50-65-7
Molecular Weight (g/mol)	327.12
MDL Number	MFCD00057597
SMILES	OC1=CC=C(Cl)C=C1C(=O)NC1=CC=C(C=C1Cl)[N+]([O-])=O
Synonym	niclosamide,5-chloro-n-2-chloro-4-nitrophenyl-2-hydroxybenzamide,niclocide,bayluscid,phenasal,tredemine,fenasal,yomesan,dichlosale,helmiantin
IUPAC Name	5-chloro-N-(2-chloro-4-nitrophenyl)-2-hydroxybenzamide
InChI Key	RJMUSRYZPJIFPJ-UHFFFAOYSA-N
Molecular Formula	C13H8Cl2N2O4

589

9,10-Dimethylanthracene, 97%

CAS: 781-43-1 Molecular Formula: C16H14 Molecular Weight (g/mol): 206.29 MDL Number: MFCD00001262 InChI Key: JTGMTYWYUZDRBK-UHFFFAOYSA-N Synonym: anthracene, 9,10-dimethyl,unii-di986077vr,ccris 2742,9,10-dimethyl-anthracene,gnf-pf-2329,acmc-209pdj,9,10-dimethylanthracen,9:10-dimethylanthracene,anthracene,10-dimethyl,9,10-dimethylanthracene PubChem CID: 13076 IUPAC Name: 9,10-dimethylanthracene SMILES: CC1=C2C=CC=CC2=C(C)C2=CC=CC=C12

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Specifications

PubChem CID	13076
CAS	781-43-1
Molecular Weight (g/mol)	206.29
MDL Number	MFCD00001262
SMILES	CC1=C2C=CC=CC2=C(C)C2=CC=CC=C12
Synonym	anthracene, 9,10-dimethyl,unii-di986077vr,ccris 2742,9,10-dimethyl-anthracene,gnf-pf-2329,acmc-209pdj,9,10-dimethylanthracen,9:10-dimethylanthracene,anthracene,10-dimethyl,9,10-dimethylanthracene
IUPAC Name	9,10-dimethylanthracene
InChI Key	JTGMTYWYUZDRBK-UHFFFAOYSA-N
Molecular Formula	C16H14

590

4,5-Dihydroxynaphthalene-2,7-disulfonic acid disodium salt dihydrate, ACS

CAS: 5808-22-0 Molecular Formula: C10H10Na2O10S2 Molecular Weight (g/mol): 400.28 MDL Number: MFCD00150612 InChI Key: QUEAKWJKJBFNEG-UHFFFAOYSA-L Synonym: chromotropic acid sodium salt,4,5-dihydroxy-2,7-naphthalenedisulfonate,di sodium; 4,5-dihydroxy-7-sulfo-naphthalene-2-sulfonic acid,4,5-dihydroxynaphthalene-2,7-disulfonic acid disodium salt dihydrate, acs 5g PubChem CID: 124202444 IUPAC Name: 2,7-disodium 4,5-dihydroxynaphthalene-2,7-disulfonate dihydrate SMILES: O.O.OC1=CC(=CC2=CC(=CC(O)=C12)S(=O)(=O)O[Na])S(=O)(=O)O[Na]

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Specifications

PubChem CID	124202444
CAS	5808-22-0
Molecular Weight (g/mol)	400.28
MDL Number	MFCD00150612
SMILES	O.O.OC1=CC(=CC2=CC(=CC(O)=C12)S(=O)(=O)O[Na])S(=O)(=O)O[Na]
Synonym	chromotropic acid sodium salt,4,5-dihydroxy-2,7-naphthalenedisulfonate,di sodium; 4,5-dihydroxy-7-sulfo-naphthalene-2-sulfonic acid,4,5-dihydroxynaphthalene-2,7-disulfonic acid disodium salt dihydrate, acs 5g
IUPAC Name	2,7-disodium 4,5-dihydroxynaphthalene-2,7-disulfonate dihydrate
InChI Key	QUEAKWJKJBFNEG-UHFFFAOYSA-L
Molecular Formula	C10H10Na2O10S2

591

Thermo Scientific Chemicals Fluconazole, 98%

CAS: 86386-73-4 Molecular Formula: C₁₃H₁₂F₂N₆O Molecular Weight (g/mol): 306.27 InChI Key: RFHAOTPXVQNOHP-UHFFFAOYSA-N Synonym: fluconazole,diflucan,triflucan,elazor,biozolene,biocanol,fungata,fluconazol,fluconazolum,flucazol PubChem CID: 3365 ChEBI: CHEBI:46081 IUPAC Name: 2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol SMILES: C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)(CN3C=NC=N3)O

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Specifications

PubChem CID	3365
CAS	86386-73-4
Molecular Weight (g/mol)	306.27
ChEBI	CHEBI:46081
SMILES	C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)(CN3C=NC=N3)O
Synonym	fluconazole,diflucan,triflucan,elazor,biozolene,biocanol,fungata,fluconazol,fluconazolum,flucazol
IUPAC Name	2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol
InChI Key	RFHAOTPXVQNOHP-UHFFFAOYSA-N
Molecular Formula	C₁₃H₁₂F₂N₆O

592

4-Methylanisole, 99%

CAS: 104-93-8 Molecular Formula: C₈H₁₀O Molecular Weight (g/mol): 122.17 MDL Number: MFCD00008413 InChI Key: CHLICZRVGGXEOD-UHFFFAOYSA-N Synonym: 4-methylanisole,p-methylanisole,4-methoxytoluene,p-methoxytoluene,benzene, 1-methoxy-4-methyl,p-cresyl methyl ether,p-cresol methyl ether,anisole, p-methyl,methyl p-tolyl ether,p-tolyl methyl ether PubChem CID: 7731 IUPAC Name: 1-methoxy-4-methylbenzene SMILES: CC1=CC=C(C=C1)OC

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Specifications

PubChem CID	7731
CAS	104-93-8
Molecular Weight (g/mol)	122.17
MDL Number	MFCD00008413
SMILES	CC1=CC=C(C=C1)OC
Synonym	4-methylanisole,p-methylanisole,4-methoxytoluene,p-methoxytoluene,benzene, 1-methoxy-4-methyl,p-cresyl methyl ether,p-cresol methyl ether,anisole, p-methyl,methyl p-tolyl ether,p-tolyl methyl ether
IUPAC Name	1-methoxy-4-methylbenzene
InChI Key	CHLICZRVGGXEOD-UHFFFAOYSA-N
Molecular Formula	C₈H₁₀O

593

1-Naphthol 99.0+%, TCI America™

CAS: 90-15-3 Molecular Formula: C10H8O Molecular Weight (g/mol): 144.173 MDL Number: MFCD00003930 InChI Key: KJCVRFUGPWSIIH-UHFFFAOYSA-N Synonym: 1-naphthol,1-naphthalenol,alpha-naphthol,1-hydroxynaphthalene,naphthol,fouramine ern,fourrine ern,tertral ern,furro er,basf ursol ern PubChem CID: 7005 ChEBI: CHEBI:10319 IUPAC Name: naphthalen-1-ol SMILES: C1=CC=C2C(=C1)C=CC=C2O

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Specifications

PubChem CID	7005
CAS	90-15-3
Molecular Weight (g/mol)	144.173
ChEBI	CHEBI:10319
MDL Number	MFCD00003930
SMILES	C1=CC=C2C(=C1)C=CC=C2O
Synonym	1-naphthol,1-naphthalenol,alpha-naphthol,1-hydroxynaphthalene,naphthol,fouramine ern,fourrine ern,tertral ern,furro er,basf ursol ern
IUPAC Name	naphthalen-1-ol
InChI Key	KJCVRFUGPWSIIH-UHFFFAOYSA-N
Molecular Formula	C10H8O

594

4-(Trifluoromethyl)benzoic acid, 98+%

CAS: 455-24-3 Molecular Formula: C8H5F3O2 Molecular Weight (g/mol): 190.121 MDL Number: MFCD00002562 InChI Key: SWKPKONEIZGROQ-UHFFFAOYSA-N Synonym: 4-trifluoromethyl benzoic acid,p-trifluoromethylbenzoic acid,alpha,alpha,alpha-trifluoro-p-toluic acid,benzoic acid, 4-trifluoromethyl,p-carboxybenzotrifluoride,4-trifluoromethyl-benzoic acid,a,a,a-trifluoro-p-toluic acid,ptf-boa,4-carboxybenzotrifluoride PubChem CID: 9966 ChEBI: CHEBI:60696 IUPAC Name: 4-(trifluoromethyl)benzoic acid SMILES: C1=CC(=CC=C1C(=O)O)C(F)(F)F

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Specifications

PubChem CID	9966
CAS	455-24-3
Molecular Weight (g/mol)	190.121
ChEBI	CHEBI:60696
MDL Number	MFCD00002562
SMILES	C1=CC(=CC=C1C(=O)O)C(F)(F)F
Synonym	4-trifluoromethyl benzoic acid,p-trifluoromethylbenzoic acid,alpha,alpha,alpha-trifluoro-p-toluic acid,benzoic acid, 4-trifluoromethyl,p-carboxybenzotrifluoride,4-trifluoromethyl-benzoic acid,a,a,a-trifluoro-p-toluic acid,ptf-boa,4-carboxybenzotrifluoride
IUPAC Name	4-(trifluoromethyl)benzoic acid
InChI Key	SWKPKONEIZGROQ-UHFFFAOYSA-N
Molecular Formula	C8H5F3O2

595

1,8-Naphthalic anhydride, 97%

CAS: 81-84-5 Molecular Formula: C12H6O3 Molecular Weight (g/mol): 198.18 MDL Number: MFCD00006925 InChI Key: GRSMWKLPSNHDHA-UHFFFAOYSA-N Synonym: 1,8-naphthalic anhydride,benzo de isochromene-1,3-dione,naphthalic anhydride,protect,naphthalic acid anhydride,1,8-naphthalic acid anhydride,pakarli,protect agrochemical,1h,3h-naphtho 1,8-cd pyran-1,3-dione,1h,3h-benzo de isochromene-1,3-dione PubChem CID: 6693 ChEBI: CHEBI:82246 IUPAC Name: 3-oxatricyclo[7.3.1.0⁵,¹³]trideca-1(13),5,7,9,11-pentaene-2,4-dione SMILES: O=C1OC(=O)C2=C3C(C=CC=C13)=CC=C2

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Specifications

PubChem CID	6693
CAS	81-84-5
Molecular Weight (g/mol)	198.18
ChEBI	CHEBI:82246
MDL Number	MFCD00006925
SMILES	O=C1OC(=O)C2=C3C(C=CC=C13)=CC=C2
Synonym	1,8-naphthalic anhydride,benzo de isochromene-1,3-dione,naphthalic anhydride,protect,naphthalic acid anhydride,1,8-naphthalic acid anhydride,pakarli,protect agrochemical,1h,3h-naphtho 1,8-cd pyran-1,3-dione,1h,3h-benzo de isochromene-1,3-dione
IUPAC Name	3-oxatricyclo[7.3.1.0⁵,¹³]trideca-1(13),5,7,9,11-pentaene-2,4-dione
InChI Key	GRSMWKLPSNHDHA-UHFFFAOYSA-N
Molecular Formula	C12H6O3

596

Butyl 4-hydroxybenzoate, 99+%

CAS: 94-26-8 Molecular Formula: C₁₁H₁₄O₃ Molecular Weight (g/mol): 194.23 MDL Number: MFCD00016478 InChI Key: QFOHBWFCKVYLES-UHFFFAOYSA-N Synonym: butylparaben,butyl paraben,butyl p-hydroxybenzoate,nipabutyl,butoben,butyl chemosept,butyl parasept,butyl tegosept,butyl butex,tegosept butyl PubChem CID: 7184 IUPAC Name: butyl 4-hydroxybenzoate SMILES: CCCCOC(=O)C1=CC=C(C=C1)O

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Specifications

PubChem CID	7184
CAS	94-26-8
Molecular Weight (g/mol)	194.23
MDL Number	MFCD00016478
SMILES	CCCCOC(=O)C1=CC=C(C=C1)O
Synonym	butylparaben,butyl paraben,butyl p-hydroxybenzoate,nipabutyl,butoben,butyl chemosept,butyl parasept,butyl tegosept,butyl butex,tegosept butyl
IUPAC Name	butyl 4-hydroxybenzoate
InChI Key	QFOHBWFCKVYLES-UHFFFAOYSA-N
Molecular Formula	C₁₁H₁₄O₃

597

4-Nitrobenzyl alcohol, 99%

CAS: 619-73-8 Molecular Formula: C7H7NO3 Molecular Weight (g/mol): 153.14 MDL Number: MFCD00007376 InChI Key: JKTYGPATCNUWKN-UHFFFAOYSA-N Synonym: 4-nitrobenzyl alcohol,4-nitrophenyl methanol,p-nitrobenzyl alcohol,benzenemethanol, 4-nitro,4-nitrobenzenemethanol,p-hydroxymethyl nitrobenzene,benzyl alcohol, p-nitro,paranitrobenzyl alcohol,4-nitrobenzylalcohol,unii-86btj68y9m PubChem CID: 69275 ChEBI: CHEBI:41214 IUPAC Name: (4-nitrophenyl)methanol SMILES: OCC1=CC=C(C=C1)[N+]([O-])=O

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Specifications

PubChem CID	69275
CAS	619-73-8
Molecular Weight (g/mol)	153.14
ChEBI	CHEBI:41214
MDL Number	MFCD00007376
SMILES	OCC1=CC=C(C=C1)[N+]([O-])=O
Synonym	4-nitrobenzyl alcohol,4-nitrophenyl methanol,p-nitrobenzyl alcohol,benzenemethanol, 4-nitro,4-nitrobenzenemethanol,p-hydroxymethyl nitrobenzene,benzyl alcohol, p-nitro,paranitrobenzyl alcohol,4-nitrobenzylalcohol,unii-86btj68y9m
IUPAC Name	(4-nitrophenyl)methanol
InChI Key	JKTYGPATCNUWKN-UHFFFAOYSA-N
Molecular Formula	C7H7NO3

598

1,5-Diphenylcarbazide, 97+%

CAS: 140-22-7 Molecular Formula: C13H14N4O Molecular Weight (g/mol): 242.282 MDL Number: MFCD00003013 InChI Key: KSPIHGBHKVISFI-UHFFFAOYSA-N Synonym: 1,5-diphenylcarbazide,diphenylcarbazide,1,5-diphenylcarbohydrazide,carbonic dihydrazide, 2,2'-diphenyl,1,5-diphenylcarbonohydrazide,1,5-diphenylcabohydrazide,sym-diphenylcarbazide,n,n'-diphenylcarbazide,2,2'-diphenylcarbazide,carbohydrazide, 1,5-diphenyl PubChem CID: 8789 ChEBI: CHEBI:4641 IUPAC Name: 1,3-dianilinourea SMILES: C1=CC=C(C=C1)NNC(=O)NNC2=CC=CC=C2

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Specifications

PubChem CID	8789
CAS	140-22-7
Molecular Weight (g/mol)	242.282
ChEBI	CHEBI:4641
MDL Number	MFCD00003013
SMILES	C1=CC=C(C=C1)NNC(=O)NNC2=CC=CC=C2
Synonym	1,5-diphenylcarbazide,diphenylcarbazide,1,5-diphenylcarbohydrazide,carbonic dihydrazide, 2,2'-diphenyl,1,5-diphenylcarbonohydrazide,1,5-diphenylcabohydrazide,sym-diphenylcarbazide,n,n'-diphenylcarbazide,2,2'-diphenylcarbazide,carbohydrazide, 1,5-diphenyl
IUPAC Name	1,3-dianilinourea
InChI Key	KSPIHGBHKVISFI-UHFFFAOYSA-N
Molecular Formula	C13H14N4O

599

3-Hydroxybenzoic acid, 99%

CAS: 99-06-9 Molecular Formula: C7H6O3 Molecular Weight (g/mol): 138.12 MDL Number: MFCD00002506 InChI Key: IJFXRHURBJZNAO-UHFFFAOYSA-N Synonym: m-hydroxybenzoic acid,m-salicylic acid,3-carboxyphenol,benzoic acid, 3-hydroxy,m-hba,3-hydroxybenzoate,benzoic acid, m-hydroxy,acido m-idrossibenzoico,meta-hydroxybenzoic acid,kyselina 3-hydroxybenzoova PubChem CID: 7420 ChEBI: CHEBI:30764 IUPAC Name: 3-hydroxybenzoic acid SMILES: OC(=O)C1=CC=CC(O)=C1

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Specifications

PubChem CID	7420
CAS	99-06-9
Molecular Weight (g/mol)	138.12
ChEBI	CHEBI:30764
MDL Number	MFCD00002506
SMILES	OC(=O)C1=CC=CC(O)=C1
Synonym	m-hydroxybenzoic acid,m-salicylic acid,3-carboxyphenol,benzoic acid, 3-hydroxy,m-hba,3-hydroxybenzoate,benzoic acid, m-hydroxy,acido m-idrossibenzoico,meta-hydroxybenzoic acid,kyselina 3-hydroxybenzoova
IUPAC Name	3-hydroxybenzoic acid
InChI Key	IJFXRHURBJZNAO-UHFFFAOYSA-N
Molecular Formula	C7H6O3

600

1-Fluoro-4-iodobenzene, 99%

CAS: 352-34-1 Molecular Formula: C6H4FI Molecular Weight (g/mol): 222.00 MDL Number: MFCD00001052 InChI Key: KGNQDBQYEBMPFZ-UHFFFAOYSA-N Synonym: 4-fluoroiodobenzene,p-fluoroiodobenzene,benzene, 1-fluoro-4-iodo,4-iodofluorobenzene,p-iodofluorobenzene,4-fluoro-1-iodobenzene,4-fluoro-iodobenzene,1-fluoro-4-iodo-benzene,1-iodo-4-fluorobenzene,4-fluroiodobenzene PubChem CID: 9605 IUPAC Name: 1-fluoro-4-iodobenzene SMILES: FC1=CC=C(I)C=C1

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Specifications

PubChem CID	9605
CAS	352-34-1
Molecular Weight (g/mol)	222.00
MDL Number	MFCD00001052
SMILES	FC1=CC=C(I)C=C1
Synonym	4-fluoroiodobenzene,p-fluoroiodobenzene,benzene, 1-fluoro-4-iodo,4-iodofluorobenzene,p-iodofluorobenzene,4-fluoro-1-iodobenzene,4-fluoro-iodobenzene,1-fluoro-4-iodo-benzene,1-iodo-4-fluorobenzene,4-fluroiodobenzene
IUPAC Name	1-fluoro-4-iodobenzene
InChI Key	KGNQDBQYEBMPFZ-UHFFFAOYSA-N
Molecular Formula	C6H4FI

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