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.

4,666 – 4,680 of 55,784 results

4,666

Thermo Scientific Chemicals A-7 hydrochloride

CAS: 79127-24-5 Molecular Formula: C20H30Cl2N2O2S Molecular Weight (g/mol): 433.432 MDL Number: MFCD00209822 InChI Key: XDJCAQBTSCRBHS-UHFFFAOYSA-N Synonym: a-7 hydrochloride,n-10-aminodecyl-5-chloro-1-naphthalenesulfonamide hydrochloride,n-10-aminodecyl-5-chloronaphthalene-1-sulfonamide hydrochloride,1-10-aminodec-1-yl sulphamoyl-5-chloronaphthalene,n-10-aminodecyl-5-chloro-1-naphthalenesulphonamide hydrochloride,n-10-aminodecyl-5-chloronaphthalene-1-sulfonamide-hydrogen chloride 1/1 PubChem CID: 44119113 IUPAC Name: N-(10-aminodecyl)-5-chloronaphthalene-1-sulfonamide;hydrochloride SMILES: C1=CC2=C(C=CC=C2Cl)C(=C1)S(=O)(=O)NCCCCCCCCCCN.Cl

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Specifications

PubChem CID	44119113
CAS	79127-24-5
Molecular Weight (g/mol)	433.432
MDL Number	MFCD00209822
SMILES	C1=CC2=C(C=CC=C2Cl)C(=C1)S(=O)(=O)NCCCCCCCCCCN.Cl
Synonym	a-7 hydrochloride,n-10-aminodecyl-5-chloro-1-naphthalenesulfonamide hydrochloride,n-10-aminodecyl-5-chloronaphthalene-1-sulfonamide hydrochloride,1-10-aminodec-1-yl sulphamoyl-5-chloronaphthalene,n-10-aminodecyl-5-chloro-1-naphthalenesulphonamide hydrochloride,n-10-aminodecyl-5-chloronaphthalene-1-sulfonamide-hydrogen chloride 1/1
IUPAC Name	N-(10-aminodecyl)-5-chloronaphthalene-1-sulfonamide;hydrochloride
InChI Key	XDJCAQBTSCRBHS-UHFFFAOYSA-N
Molecular Formula	C20H30Cl2N2O2S

4,667

Thermo Scientific Chemicals 2-Methoxy-4-methylbenzenesulfonamide, 95%

CAS: 59554-39-1 Molecular Formula: C8H11NO3S Molecular Weight (g/mol): 201.24 MDL Number: MFCD01318156 InChI Key: GQUFSEOISDLWMN-UHFFFAOYSA-N Synonym: 2-methoxy-4-methyl-benzenesulfonamide,2-methoxy-4-methylbenzene-1-sulfonamide,acmc-20ans2,3-methoxy-p-toluenesulfonamide,benzenesulfonamide,2-methoxy-4-methyl,2-methoxy-4-methyl-1-benzenesulfonamide PubChem CID: 5093369 IUPAC Name: 2-methoxy-4-methylbenzenesulfonamide SMILES: CC1=CC(=C(C=C1)S(=O)(=O)N)OC

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Specifications

PubChem CID	5093369
CAS	59554-39-1
Molecular Weight (g/mol)	201.24
MDL Number	MFCD01318156
SMILES	CC1=CC(=C(C=C1)S(=O)(=O)N)OC
Synonym	2-methoxy-4-methyl-benzenesulfonamide,2-methoxy-4-methylbenzene-1-sulfonamide,acmc-20ans2,3-methoxy-p-toluenesulfonamide,benzenesulfonamide,2-methoxy-4-methyl,2-methoxy-4-methyl-1-benzenesulfonamide
IUPAC Name	2-methoxy-4-methylbenzenesulfonamide
InChI Key	GQUFSEOISDLWMN-UHFFFAOYSA-N
Molecular Formula	C8H11NO3S

4,668

Thermo Scientific Chemicals 1-Iodo-3-nitrobenzene, 99%

CAS: 645-00-1 Molecular Formula: C6H4INO2 Molecular Weight (g/mol): 249.007 MDL Number: MFCD00007218 InChI Key: CBYAZOKPJYBCHE-UHFFFAOYSA-N Synonym: 3-iodonitrobenzene,m-iodonitrobenzene,benzene, 1-iodo-3-nitro,3-nitroiodobenzene,meta-iodonitrobenzene,3-i-nitrobenzene,iodo-3-nitrobenzene,meta-nitroiodobenzene,1-iodo-3-nitro-benzene,3-nitro-iodobenzen PubChem CID: 12574 ChEBI: CHEBI:67123 IUPAC Name: 1-iodo-3-nitrobenzene SMILES: C1=CC(=CC(=C1)I)[N+](=O)[O-]

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Specifications

PubChem CID	12574
CAS	645-00-1
Molecular Weight (g/mol)	249.007
ChEBI	CHEBI:67123
MDL Number	MFCD00007218
SMILES	C1=CC(=CC(=C1)I)[N+](=O)[O-]
Synonym	3-iodonitrobenzene,m-iodonitrobenzene,benzene, 1-iodo-3-nitro,3-nitroiodobenzene,meta-iodonitrobenzene,3-i-nitrobenzene,iodo-3-nitrobenzene,meta-nitroiodobenzene,1-iodo-3-nitro-benzene,3-nitro-iodobenzen
IUPAC Name	1-iodo-3-nitrobenzene
InChI Key	CBYAZOKPJYBCHE-UHFFFAOYSA-N
Molecular Formula	C6H4INO2

4,669

Thermo Scientific Chemicals 4-n-Butoxyphenol, 98%

CAS: 122-94-1 Molecular Formula: C10H14O2 Molecular Weight (g/mol): 166.22 MDL Number: MFCD00002336 InChI Key: MBGGFXOXUIDRJD-UHFFFAOYSA-N Synonym: phenol, 4-butoxy,p-butoxyphenol,4-n-butoxyphenol,phenol, p-butoxy,hydroquinone monobutyl ether,unii-8188dbs68j,4-normal-butoxyphenol,4-butoxy-pheno,4-butoxy-phenol,4-n-butyloxyphenol PubChem CID: 31233 ChEBI: CHEBI:34392 IUPAC Name: 4-butoxyphenol SMILES: CCCCOC1=CC=C(O)C=C1

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Specifications

PubChem CID	31233
CAS	122-94-1
Molecular Weight (g/mol)	166.22
ChEBI	CHEBI:34392
MDL Number	MFCD00002336
SMILES	CCCCOC1=CC=C(O)C=C1
Synonym	phenol, 4-butoxy,p-butoxyphenol,4-n-butoxyphenol,phenol, p-butoxy,hydroquinone monobutyl ether,unii-8188dbs68j,4-normal-butoxyphenol,4-butoxy-pheno,4-butoxy-phenol,4-n-butyloxyphenol
IUPAC Name	4-butoxyphenol
InChI Key	MBGGFXOXUIDRJD-UHFFFAOYSA-N
Molecular Formula	C10H14O2

4,670

3,5-Di-tert-butylcatechol, 99%, Thermo Scientific Chemicals

CAS: 1020-31-1 Molecular Formula: C₁₄H₂₂O₂ Molecular Weight (g/mol): 222.33 MDL Number: MFCD00008819 InChI Key: PJZLSMMERMMQBJ-UHFFFAOYSA-N Synonym: 3,5-di-tert-butylcatechol,3,5-di-t-butylcatechol,3,5-di-tert-butylbenzene-1,2-diol,3,5-di-tert-butylpyrocatechol,1,2-benzenediol, 3,5-bis 1,1-dimethylethyl,4,6-di-tert-butylpyrocatechol,unii-1328kn3f8b,1,2-benzenediol, 3,5-di 1,1-dimethylethyl,pyrocatechol, 3,5-di-tert-butyl,3,5-bis tert-butyl benzene-1,2-diol PubChem CID: 66099 IUPAC Name: 3,5-ditert-butylbenzene-1,2-diol SMILES: CC(C)(C)C1=CC(=C(C(=C1)O)O)C(C)(C)C

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Specifications

PubChem CID	66099
CAS	1020-31-1
Molecular Weight (g/mol)	222.33
MDL Number	MFCD00008819
SMILES	CC(C)(C)C1=CC(=C(C(=C1)O)O)C(C)(C)C
Synonym	3,5-di-tert-butylcatechol,3,5-di-t-butylcatechol,3,5-di-tert-butylbenzene-1,2-diol,3,5-di-tert-butylpyrocatechol,1,2-benzenediol, 3,5-bis 1,1-dimethylethyl,4,6-di-tert-butylpyrocatechol,unii-1328kn3f8b,1,2-benzenediol, 3,5-di 1,1-dimethylethyl,pyrocatechol, 3,5-di-tert-butyl,3,5-bis tert-butyl benzene-1,2-diol
IUPAC Name	3,5-ditert-butylbenzene-1,2-diol
InChI Key	PJZLSMMERMMQBJ-UHFFFAOYSA-N
Molecular Formula	C₁₄H₂₂O₂

4,671

Thermo Scientific Chemicals 2,6-Dichlorobenzamide, 97%

CAS: 2008-58-4 Molecular Formula: C₇H₅Cl₂NO Molecular Weight (g/mol): 190.03 MDL Number: MFCD00007975 InChI Key: JHSPCUHPSIUQRB-UHFFFAOYSA-N Synonym: benzamide, 2,6-dichloro,2,6-bam,unii-e9jwf529eb,2,6-dichlorobenzoic acid amide,bam,e9jwf529eb,benzamide,6-dichloro,dsstox_cid_2170,acmc-209f5j,dsstox_rid_76511 PubChem CID: 16183 ChEBI: CHEBI:28435 IUPAC Name: 2,6-dichlorobenzamide SMILES: C1=CC(=C(C(=C1)Cl)C(=O)N)Cl

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Specifications

PubChem CID	16183
CAS	2008-58-4
Molecular Weight (g/mol)	190.03
ChEBI	CHEBI:28435
MDL Number	MFCD00007975
SMILES	C1=CC(=C(C(=C1)Cl)C(=O)N)Cl
Synonym	benzamide, 2,6-dichloro,2,6-bam,unii-e9jwf529eb,2,6-dichlorobenzoic acid amide,bam,e9jwf529eb,benzamide,6-dichloro,dsstox_cid_2170,acmc-209f5j,dsstox_rid_76511
IUPAC Name	2,6-dichlorobenzamide
InChI Key	JHSPCUHPSIUQRB-UHFFFAOYSA-N
Molecular Formula	C₇H₅Cl₂NO

4,672

Thermo Scientific Chemicals 2,6-Dichlorobenzoic Acid, 98+%

CAS: 50-30-6 Molecular Formula: C7H4Cl2O2 Molecular Weight (g/mol): 191.01 MDL Number: MFCD00002418 InChI Key: MRUDNSFOFOQZDA-UHFFFAOYSA-N Synonym: benzoic acid, 2,6-dichloro,2,6-dichloro-benzoic acid,unii-634ri764qt,2,6 dichlorobenzoic acid,2,6-dichlorobenzoicacid,2,6-dichloro-benzoicacid,ccris 8610,pubchem20028,acmc-1auop,2.6-dichlorobenzoic acid PubChem CID: 5758 ChEBI: CHEBI:48623 IUPAC Name: 2,6-dichlorobenzoic acid SMILES: OC(=O)C1=C(Cl)C=CC=C1Cl

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Specifications

PubChem CID	5758
CAS	50-30-6
Molecular Weight (g/mol)	191.01
ChEBI	CHEBI:48623
MDL Number	MFCD00002418
SMILES	OC(=O)C1=C(Cl)C=CC=C1Cl
Synonym	benzoic acid, 2,6-dichloro,2,6-dichloro-benzoic acid,unii-634ri764qt,2,6 dichlorobenzoic acid,2,6-dichlorobenzoicacid,2,6-dichloro-benzoicacid,ccris 8610,pubchem20028,acmc-1auop,2.6-dichlorobenzoic acid
IUPAC Name	2,6-dichlorobenzoic acid
InChI Key	MRUDNSFOFOQZDA-UHFFFAOYSA-N
Molecular Formula	C7H4Cl2O2

4,673

Thermo Scientific Chemicals Didecyl phthalate, 95%

CAS: 84-77-5 Molecular Formula: C28H46O4 Molecular Weight (g/mol): 446.67 MDL Number: MFCD00041915 InChI Key: PGIBJVOPLXHHGS-UHFFFAOYSA-N Synonym: didecyl phthalate,decyl phthalate,di-n-decyl phthalate,vinicizer 105,phthalic acid, didecyl ester,vinysize 105,1,2-benzenedicarboxylic acid, didecyl ester,bis n-decyl phthalate,didecyl 1,2-benzenedicarboxylate,unii-fi5fbn947z PubChem CID: 6788 ChEBI: CHEBI:34676 IUPAC Name: didecyl benzene-1,2-dicarboxylate SMILES: CCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCCC

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Specifications

PubChem CID	6788
CAS	84-77-5
Molecular Weight (g/mol)	446.67
ChEBI	CHEBI:34676
MDL Number	MFCD00041915
SMILES	CCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCCC
Synonym	didecyl phthalate,decyl phthalate,di-n-decyl phthalate,vinicizer 105,phthalic acid, didecyl ester,vinysize 105,1,2-benzenedicarboxylic acid, didecyl ester,bis n-decyl phthalate,didecyl 1,2-benzenedicarboxylate,unii-fi5fbn947z
IUPAC Name	didecyl benzene-1,2-dicarboxylate
InChI Key	PGIBJVOPLXHHGS-UHFFFAOYSA-N
Molecular Formula	C28H46O4

4,674

Thermo Scientific Chemicals 4-(Diethylamino)benzaldehyde, 99%

CAS: 120-21-8 Molecular Formula: C₁₁H₁₅NO Molecular Weight (g/mol): 177.25 MDL Number: MFCD00003382 InChI Key: MNFZZNNFORDXSV-UHFFFAOYSA-N Synonym: 4-diethylamino benzaldehyde,benzaldehyde, 4-diethylamino,p-diethylamino benzaldehyde,p-formyl-n,n-diethylaniline,4-diethylamino-benzaldehyde,benzaldehyde, p-diethylamino,unii-s640xwl10h,p-n,n-diethylaminobenzaldehyde,p-diethylaminobenzaldehyde,4-n,n-diethylamino benzaldehyde PubChem CID: 67114 ChEBI: CHEBI:86194 IUPAC Name: 4-(diethylamino)benzaldehyde SMILES: CCN(CC)C1=CC=C(C=C1)C=O

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Specifications

PubChem CID	67114
CAS	120-21-8
Molecular Weight (g/mol)	177.25
ChEBI	CHEBI:86194
MDL Number	MFCD00003382
SMILES	CCN(CC)C1=CC=C(C=C1)C=O
Synonym	4-diethylamino benzaldehyde,benzaldehyde, 4-diethylamino,p-diethylamino benzaldehyde,p-formyl-n,n-diethylaniline,4-diethylamino-benzaldehyde,benzaldehyde, p-diethylamino,unii-s640xwl10h,p-n,n-diethylaminobenzaldehyde,p-diethylaminobenzaldehyde,4-n,n-diethylamino benzaldehyde
IUPAC Name	4-(diethylamino)benzaldehyde
InChI Key	MNFZZNNFORDXSV-UHFFFAOYSA-N
Molecular Formula	C₁₁H₁₅NO

4,675

Thermo Scientific Chemicals Diethylstilbestrol, 99%

CAS: 56-53-1 Molecular Formula: C18H20O2 Molecular Weight (g/mol): 268.36 MDL Number: MFCD00002373 InChI Key: RGLYKWWBQGJZGM-ISLYRVAYSA-N Synonym: diethylstilbestrol,stilbestrol,stilboestrol,distilbene,agostilben,estrobene,estromenin,stilboestroform,antigestil,palestrol PubChem CID: 448537 ChEBI: CHEBI:41922 SMILES: CC\C(=C(\CC)C1=CC=C(O)C=C1)C1=CC=C(O)C=C1

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Specifications

PubChem CID	448537
CAS	56-53-1
Molecular Weight (g/mol)	268.36
ChEBI	CHEBI:41922
MDL Number	MFCD00002373
SMILES	CC\C(=C(\CC)C1=CC=C(O)C=C1)C1=CC=C(O)C=C1
Synonym	diethylstilbestrol,stilbestrol,stilboestrol,distilbene,agostilben,estrobene,estromenin,stilboestroform,antigestil,palestrol
InChI Key	RGLYKWWBQGJZGM-ISLYRVAYSA-N
Molecular Formula	C18H20O2

4,676

Thermo Scientific Chemicals 2,3-Dihydroxynaphthalene, 97%

CAS: 92-44-4 Molecular Formula: C10H8O2 Molecular Weight (g/mol): 160.17 MDL Number: MFCD00004073 InChI Key: JRNGUTKWMSBIBF-UHFFFAOYSA-N Synonym: 2,3-dihydroxynaphthalene,2,3-naphthalenediol,2,3-dihydroxynapthalene,2,3-dihydroxy naphthalene,2,3-dihydroxynaphthlene,naphthalenediol-2,3,3-hydroxy-2-naphthol,2,3dihydroxynaphthalene,acmc-209rfr,2,3-dihydroxylnaphthalene PubChem CID: 7091 ChEBI: CHEBI:38135 IUPAC Name: naphthalene-2,3-diol SMILES: OC1=C(O)C=C2C=CC=CC2=C1

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Specifications

PubChem CID	7091
CAS	92-44-4
Molecular Weight (g/mol)	160.17
ChEBI	CHEBI:38135
MDL Number	MFCD00004073
SMILES	OC1=C(O)C=C2C=CC=CC2=C1
Synonym	2,3-dihydroxynaphthalene,2,3-naphthalenediol,2,3-dihydroxynapthalene,2,3-dihydroxy naphthalene,2,3-dihydroxynaphthlene,naphthalenediol-2,3,3-hydroxy-2-naphthol,2,3dihydroxynaphthalene,acmc-209rfr,2,3-dihydroxylnaphthalene
IUPAC Name	naphthalene-2,3-diol
InChI Key	JRNGUTKWMSBIBF-UHFFFAOYSA-N
Molecular Formula	C10H8O2

4,677

Thermo Scientific Chemicals 1,4-Dimethoxybenzene, 99+%

CAS: 150-78-7 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.17 MDL Number: MFCD00008401 InChI Key: OHBQPCCCRFSCAX-UHFFFAOYSA-N Synonym: p-dimethoxybenzene,p-methoxyanisole,hydroquinone dimethyl ether,benzene, 1,4-dimethoxy,quinol dimethyl ether,benzene, p-dimethoxy,dimethylhydroquinone ether,dimethyl ether hydroquinone,1,4-dimethoxybenzol,usaf an-9 PubChem CID: 9016 IUPAC Name: 1,4-dimethoxybenzene SMILES: COC1=CC=C(OC)C=C1

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Specifications

PubChem CID	9016
CAS	150-78-7
Molecular Weight (g/mol)	138.17
MDL Number	MFCD00008401
SMILES	COC1=CC=C(OC)C=C1
Synonym	p-dimethoxybenzene,p-methoxyanisole,hydroquinone dimethyl ether,benzene, 1,4-dimethoxy,quinol dimethyl ether,benzene, p-dimethoxy,dimethylhydroquinone ether,dimethyl ether hydroquinone,1,4-dimethoxybenzol,usaf an-9
IUPAC Name	1,4-dimethoxybenzene
InChI Key	OHBQPCCCRFSCAX-UHFFFAOYSA-N
Molecular Formula	C8H10O2

4,678

Thermo Scientific Chemicals 4,4'-Dimethoxybenzophenone, 97%

CAS: 90-96-0 Molecular Formula: C15H14O3 Molecular Weight (g/mol): 242.27 MDL Number: MFCD00008404 InChI Key: RFVHVYKVRGKLNK-UHFFFAOYSA-N Synonym: 4,4'-dimethoxybenzophenone,bis 4-methoxyphenyl methanone,methanone, bis 4-methoxyphenyl,p,p'-dimethoxybenzophenone,dmbp,bis p-anisyl ketone,bis 4-anisyl ketone,bis p-methoxy benzophenone,benzophenone, 4,4'-dimethoxy,1,1-di p-methoxyphenyl-ketone PubChem CID: 7032 IUPAC Name: bis(4-methoxyphenyl)methanone SMILES: COC1=CC=C(C=C1)C(=O)C1=CC=C(OC)C=C1

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Specifications

PubChem CID	7032
CAS	90-96-0
Molecular Weight (g/mol)	242.27
MDL Number	MFCD00008404
SMILES	COC1=CC=C(C=C1)C(=O)C1=CC=C(OC)C=C1
Synonym	4,4'-dimethoxybenzophenone,bis 4-methoxyphenyl methanone,methanone, bis 4-methoxyphenyl,p,p'-dimethoxybenzophenone,dmbp,bis p-anisyl ketone,bis 4-anisyl ketone,bis p-methoxy benzophenone,benzophenone, 4,4'-dimethoxy,1,1-di p-methoxyphenyl-ketone
IUPAC Name	bis(4-methoxyphenyl)methanone
InChI Key	RFVHVYKVRGKLNK-UHFFFAOYSA-N
Molecular Formula	C15H14O3

4,679

4-Dimethylaminobenzaldehyde, 98%, Thermo Scientific Chemicals

CAS: 100-10-7 Molecular Formula: C9H11NO Molecular Weight (g/mol): 149.19 MDL Number: MFCD00003381 InChI Key: BGNGWHSBYQYVRX-UHFFFAOYSA-N Synonym: 4-dimethylamino benzaldehyde,p-dimethylaminobenzaldehyde,ehrlich's reagent,p-formyldimethylaniline,benzaldehyde, 4-dimethylamino,p-dimethylamino benzaldehyde,p-formyl-n,n-dimethylaniline,n,n-dimethyl-p-aminobenzaldehyde,p-n,n-dimethylamino benzaldehyde,4-dimethylaminobenzenecarbonal PubChem CID: 7479 IUPAC Name: 4-(dimethylamino)benzaldehyde SMILES: CN(C)C1=CC=C(C=O)C=C1

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Specifications

PubChem CID	7479
CAS	100-10-7
Molecular Weight (g/mol)	149.19
MDL Number	MFCD00003381
SMILES	CN(C)C1=CC=C(C=O)C=C1
Synonym	4-dimethylamino benzaldehyde,p-dimethylaminobenzaldehyde,ehrlich's reagent,p-formyldimethylaniline,benzaldehyde, 4-dimethylamino,p-dimethylamino benzaldehyde,p-formyl-n,n-dimethylaniline,n,n-dimethyl-p-aminobenzaldehyde,p-n,n-dimethylamino benzaldehyde,4-dimethylaminobenzenecarbonal
IUPAC Name	4-(dimethylamino)benzaldehyde
InChI Key	BGNGWHSBYQYVRX-UHFFFAOYSA-N
Molecular Formula	C9H11NO

4,680

9,10-Dimethylanthracene, 97%, Thermo Scientific Chemicals

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

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