Aromatic hydrocarbons

Organic compounds made up entirely of hydrogen and carbon elements usually organized in a chain, and have an aromatic (aryl) functional group.

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Ethylbenzene, 99.8%, anhydrous, AcroSeal™

CAS: 100-41-4 Molecular Formula: C₈H₁₀ Molecular Weight (g/mol): 106.17 InChI Key: YNQLUTRBYVCPMQ-UHFFFAOYSA-N Synonym: phenylethane,ethylbenzol,benzene, ethyl,aethylbenzol,ethylenzene,ethyl benzene,ethylbenzeen,etilbenzene,etylobenzen,alpha-methyltoluene PubChem CID: 7500 ChEBI: CHEBI:16101 IUPAC Name: ethylbenzene SMILES: CCC1=CC=CC=C1

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PubChem CID	7500
CAS	100-41-4
Molecular Weight (g/mol)	106.17
ChEBI	CHEBI:16101
SMILES	CCC1=CC=CC=C1
Synonym	phenylethane,ethylbenzol,benzene, ethyl,aethylbenzol,ethylenzene,ethyl benzene,ethylbenzeen,etilbenzene,etylobenzen,alpha-methyltoluene
IUPAC Name	ethylbenzene
InChI Key	YNQLUTRBYVCPMQ-UHFFFAOYSA-N
Molecular Formula	C₈H₁₀

Ethylbenzene, ≥99 %

CAS: 100-41-4 Molecular Formula: C8H10 Molecular Weight (g/mol): 106.168 MDL Number: MFCD00011647 InChI Key: YNQLUTRBYVCPMQ-UHFFFAOYSA-N Synonym: phenylethane,ethylbenzol,benzene, ethyl,aethylbenzol,ethylenzene,ethyl benzene,ethylbenzeen,etilbenzene,etylobenzen,alpha-methyltoluene PubChem CID: 7500 ChEBI: CHEBI:16101 IUPAC Name: ethylbenzene SMILES: CCC1=CC=CC=C1

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Specifications

PubChem CID	7500
CAS	100-41-4
Molecular Weight (g/mol)	106.168
ChEBI	CHEBI:16101
MDL Number	MFCD00011647
SMILES	CCC1=CC=CC=C1
Synonym	phenylethane,ethylbenzol,benzene, ethyl,aethylbenzol,ethylenzene,ethyl benzene,ethylbenzeen,etilbenzene,etylobenzen,alpha-methyltoluene
IUPAC Name	ethylbenzene
InChI Key	YNQLUTRBYVCPMQ-UHFFFAOYSA-N
Molecular Formula	C8H10

1,2,4,5-Tetramethylbenzene, 97+%

CAS: 95-93-2 Molecular Formula: C10H14 Molecular Weight (g/mol): 134.222 MDL Number: MFCD00008528 InChI Key: SQNZJJAZBFDUTD-UHFFFAOYSA-N Synonym: durene,durol,benzene, 1,2,4,5-tetramethyl,unii-181426cfyb,p-xylene, 2,5-dimethyl,dsstox_cid_9124,dsstox_rid_78675,dsstox_gsid_29124,duren PubChem CID: 7269 ChEBI: CHEBI:38978 IUPAC Name: 1,2,4,5-tetramethylbenzene SMILES: CC1=CC(=C(C=C1C)C)C

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PubChem CID	7269
CAS	95-93-2
Molecular Weight (g/mol)	134.222
ChEBI	CHEBI:38978
MDL Number	MFCD00008528
SMILES	CC1=CC(=C(C=C1C)C)C
Synonym	durene,durol,benzene, 1,2,4,5-tetramethyl,unii-181426cfyb,p-xylene, 2,5-dimethyl,dsstox_cid_9124,dsstox_rid_78675,dsstox_gsid_29124,duren
IUPAC Name	1,2,4,5-tetramethylbenzene
InChI Key	SQNZJJAZBFDUTD-UHFFFAOYSA-N
Molecular Formula	C10H14

Mesitylene, 99%, Extra Pure

CAS: 108-67-8 Molecular Formula: C₉H₁₂ Molecular Weight (g/mol): 120.19 MDL Number: MFCD00008538 InChI Key: AUHZEENZYGFFBQ-UHFFFAOYSA-N Synonym: mesitylene,sym-trimethylbenzene,benzene, 1,3,5-trimethyl,fleet-x,trimethylbenzol,3,5-dimethyltoluene,s-trimethylbenzene,hsdb 92,2,4,6-trimethylbenzene,1,3,5-trimethyl-benzene PubChem CID: 7947 ChEBI: CHEBI:34833 IUPAC Name: 1,3,5-trimethylbenzene SMILES: CC1=CC(=CC(=C1)C)C

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Specifications

PubChem CID	7947
CAS	108-67-8
Molecular Weight (g/mol)	120.19
ChEBI	CHEBI:34833
MDL Number	MFCD00008538
SMILES	CC1=CC(=CC(=C1)C)C
Synonym	mesitylene,sym-trimethylbenzene,benzene, 1,3,5-trimethyl,fleet-x,trimethylbenzol,3,5-dimethyltoluene,s-trimethylbenzene,hsdb 92,2,4,6-trimethylbenzene,1,3,5-trimethyl-benzene
IUPAC Name	1,3,5-trimethylbenzene
InChI Key	AUHZEENZYGFFBQ-UHFFFAOYSA-N
Molecular Formula	C₉H₁₂

3-Phenyltoluene, 95%

CAS: 643-93-6 Molecular Formula: C₁₃H₁₂ Molecular Weight (g/mol): 168.24 MDL Number: MFCD00008533 InChI Key: NPDIDUXTRAITDE-UHFFFAOYSA-N Synonym: 3-methylbiphenyl,3-phenyltoluene,3-methyl-1,1'biphenyl,1,1'-biphenyl, 3-methyl,3-methyl-1,1'-biphenyl,biphenyl, 3-methyl,unii-kfp6eo4j6p,kfp6eo4j6p,1-methyl-3-phenyl-benzene,3-methyl-biphenyl PubChem CID: 12564 IUPAC Name: 1-methyl-3-phenylbenzene SMILES: CC1=CC=CC(=C1)C2=CC=CC=C2

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Specifications

PubChem CID	12564
CAS	643-93-6
Molecular Weight (g/mol)	168.24
MDL Number	MFCD00008533
SMILES	CC1=CC=CC(=C1)C2=CC=CC=C2
Synonym	3-methylbiphenyl,3-phenyltoluene,3-methyl-1,1'biphenyl,1,1'-biphenyl, 3-methyl,3-methyl-1,1'-biphenyl,biphenyl, 3-methyl,unii-kfp6eo4j6p,kfp6eo4j6p,1-methyl-3-phenyl-benzene,3-methyl-biphenyl
IUPAC Name	1-methyl-3-phenylbenzene
InChI Key	NPDIDUXTRAITDE-UHFFFAOYSA-N
Molecular Formula	C₁₃H₁₂

1,3-Diethylbenzene, 97+%

CAS: 141-93-5 Molecular Formula: C10H14 Molecular Weight (g/mol): 134.222 MDL Number: MFCD00009260 InChI Key: AFZZYIJIWUTJFO-UHFFFAOYSA-N Synonym: m-diethylbenzene,benzene, 1,3-diethyl,benzene, m-diethyl,m-ethylethylbenzene,unii-zm2x7i1g8y,zm2x7i1g8y,ethylated benzene,benzene, ethylated,meta-diethylbenzene,polyethylated benzene PubChem CID: 8864 IUPAC Name: 1,3-diethylbenzene SMILES: CCC1=CC(=CC=C1)CC

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Specifications

PubChem CID	8864
CAS	141-93-5
Molecular Weight (g/mol)	134.222
MDL Number	MFCD00009260
SMILES	CCC1=CC(=CC=C1)CC
Synonym	m-diethylbenzene,benzene, 1,3-diethyl,benzene, m-diethyl,m-ethylethylbenzene,unii-zm2x7i1g8y,zm2x7i1g8y,ethylated benzene,benzene, ethylated,meta-diethylbenzene,polyethylated benzene
IUPAC Name	1,3-diethylbenzene
InChI Key	AFZZYIJIWUTJFO-UHFFFAOYSA-N
Molecular Formula	C10H14

2-Methylindene, Thermo Scientific Chemicals

CAS: 2177-47-1 Molecular Formula: C10H10 Molecular Weight (g/mol): 130.19 MDL Number: MFCD00274253 InChI Key: YSAXEHWHSLANOM-UHFFFAOYSA-N IUPAC Name: 2-methyl-1H-indene SMILES: CC1=CC2=CC=CC=C2C1

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Specifications

CAS	2177-47-1
Molecular Weight (g/mol)	130.19
MDL Number	MFCD00274253
SMILES	CC1=CC2=CC=CC=C2C1
IUPAC Name	2-methyl-1H-indene
InChI Key	YSAXEHWHSLANOM-UHFFFAOYSA-N
Molecular Formula	C10H10

Dichloro(pentamethylcyclopentadienyl)iridium(III) dimer

CAS: 12354-84-6 Molecular Formula: C20H30Cl4Ir2 Molecular Weight (g/mol): 796.694 MDL Number: MFCD00075435 InChI Key: MMAGMBCAIFVRGJ-UHFFFAOYSA-J Synonym: unii-6oy4uuc534,dichloro pentamethylcyclopentadienyl iridium iii dimer,pentamethylcyclopentadienyl iridium iii dichloride dimer,pentamethylcyclopentadienyliridium dichloride,pentamethylcyclopentadienyl iridium dichloride dimer,pentamethylcyclopentadienyliridium iii dichloride dimer,eta5-pentamethylcyclopentadienyl iridium dichloride dimer,pentamethylcyclopentadienyliridium iii dichloride dimer mi,bis mu-chloro chloro eta5-pentamethylcyclopentadienyl iridium,iridium, di-mu-chlorodichlorobis 1,2,3,4,5-eta-1,2,3,4,5-pentamethyl-2,4-cyclopentadien-1-yl di PubChem CID: 76030743 IUPAC Name: iridium(3+);1,2,3,4,5-pentamethylcyclopenta-1,3-diene;tetrachloride SMILES: C[C-]1C(=C(C(=C1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.[Cl-].[Cl-].[Cl-].[Cl-].[Ir+3].[Ir+3]

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Specifications

PubChem CID	76030743
CAS	12354-84-6
Molecular Weight (g/mol)	796.694
MDL Number	MFCD00075435
SMILES	C[C-]1C(=C(C(=C1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.[Cl-].[Cl-].[Cl-].[Cl-].[Ir+3].[Ir+3]
Synonym	unii-6oy4uuc534,dichloro pentamethylcyclopentadienyl iridium iii dimer,pentamethylcyclopentadienyl iridium iii dichloride dimer,pentamethylcyclopentadienyliridium dichloride,pentamethylcyclopentadienyl iridium dichloride dimer,pentamethylcyclopentadienyliridium iii dichloride dimer,eta5-pentamethylcyclopentadienyl iridium dichloride dimer,pentamethylcyclopentadienyliridium iii dichloride dimer mi,bis mu-chloro chloro eta5-pentamethylcyclopentadienyl iridium,iridium, di-mu-chlorodichlorobis 1,2,3,4,5-eta-1,2,3,4,5-pentamethyl-2,4-cyclopentadien-1-yl di
IUPAC Name	iridium(3+);1,2,3,4,5-pentamethylcyclopenta-1,3-diene;tetrachloride
InChI Key	MMAGMBCAIFVRGJ-UHFFFAOYSA-J
Molecular Formula	C20H30Cl4Ir2

n-Nonylbenzene, 97%

CAS: 1081-77-2 Molecular Formula: C15H24 Molecular Weight (g/mol): 204.357 MDL Number: MFCD00009575 InChI Key: LIXVMPBOGDCSRM-UHFFFAOYSA-N Synonym: 1-phenylnonane,benzene, nonyl,n-nonylbenzene,nonane, 1-phenyl,1-nonylbenzene,unii-58ak68ov26,benzene, c6-12-alkyl derivs.,n-nonyl benzene,phenyl-nonane,c6-c12 alkylbenzene PubChem CID: 14126 IUPAC Name: nonylbenzene SMILES: CCCCCCCCCC1=CC=CC=C1

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PubChem CID	14126
CAS	1081-77-2
Molecular Weight (g/mol)	204.357
MDL Number	MFCD00009575
SMILES	CCCCCCCCCC1=CC=CC=C1
Synonym	1-phenylnonane,benzene, nonyl,n-nonylbenzene,nonane, 1-phenyl,1-nonylbenzene,unii-58ak68ov26,benzene, c6-12-alkyl derivs.,n-nonyl benzene,phenyl-nonane,c6-c12 alkylbenzene
IUPAC Name	nonylbenzene
InChI Key	LIXVMPBOGDCSRM-UHFFFAOYSA-N
Molecular Formula	C15H24

4-Methylbiphenyl, 98%

CAS: 644-08-6 Molecular Formula: C13H12 Molecular Weight (g/mol): 168.24 MDL Number: MFCD00008544 InChI Key: ZZLCFHIKESPLTH-UHFFFAOYSA-N Synonym: 4-methylbiphenyl,4-phenyltoluene,4-methyl-1,1'-biphenyl,p-methylbiphenyl,p-methyldiphenyl,4-methyldiphenyl,1,1'-biphenyl, 4-methyl,biphenyl, 4-methyl,p-phenyltoluene,4-methylphenyl benzene PubChem CID: 12566 SMILES: CC1=CC=C(C=C1)C1=CC=CC=C1

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Specifications

PubChem CID	12566
CAS	644-08-6
Molecular Weight (g/mol)	168.24
MDL Number	MFCD00008544
SMILES	CC1=CC=C(C=C1)C1=CC=CC=C1
Synonym	4-methylbiphenyl,4-phenyltoluene,4-methyl-1,1'-biphenyl,p-methylbiphenyl,p-methyldiphenyl,4-methyldiphenyl,1,1'-biphenyl, 4-methyl,biphenyl, 4-methyl,p-phenyltoluene,4-methylphenyl benzene
InChI Key	ZZLCFHIKESPLTH-UHFFFAOYSA-N
Molecular Formula	C13H12

Cyclohexylbenzene, 97+%

CAS: 827-52-1 Molecular Formula: C12H16 Molecular Weight (g/mol): 160.26 MDL Number: MFCD00001451 InChI Key: IGARGHRYKHJQSM-UHFFFAOYSA-N Synonym: phenylcyclohexane,benzene, cyclohexyl,cyclohexane, phenyl,cyclohexyl-benzene,cyclohexyl benzene,4-cyclohexylbenzene,santosol 360,phenyl cyclohexane,1,1'-biphenyl, 1,2,3,4,5,6-hexahydro,wln: l6tj ar PubChem CID: 13229 IUPAC Name: cyclohexylbenzene SMILES: C1CCC(CC1)C1=CC=CC=C1

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Specifications

PubChem CID	13229
CAS	827-52-1
Molecular Weight (g/mol)	160.26
MDL Number	MFCD00001451
SMILES	C1CCC(CC1)C1=CC=CC=C1
Synonym	phenylcyclohexane,benzene, cyclohexyl,cyclohexane, phenyl,cyclohexyl-benzene,cyclohexyl benzene,4-cyclohexylbenzene,santosol 360,phenyl cyclohexane,1,1'-biphenyl, 1,2,3,4,5,6-hexahydro,wln: l6tj ar
IUPAC Name	cyclohexylbenzene
InChI Key	IGARGHRYKHJQSM-UHFFFAOYSA-N
Molecular Formula	C12H16

PubChem CID	13229
CAS	827-52-1
Molecular Weight (g/mol)	160.26
MDL Number	MFCD00001451
SMILES	C1CCC(CC1)C1=CC=CC=C1
Synonym	phenylcyclohexane,benzene, cyclohexyl,cyclohexane, phenyl,cyclohexyl-benzene,cyclohexyl benzene,4-cyclohexylbenzene,santosol 360,phenyl cyclohexane,1,1'-biphenyl, 1,2,3,4,5,6-hexahydro,wln: l6tj ar
IUPAC Name	cyclohexylbenzene
InChI Key	IGARGHRYKHJQSM-UHFFFAOYSA-N
Molecular Formula	C12H16

1,2,4-Trimethylbenzene, 98%

CAS: 95-63-6 Molecular Formula: C9H12 Molecular Weight (g/mol): 120.195 MDL Number: MFCD00008527 InChI Key: GWHJZXXIDMPWGX-UHFFFAOYSA-N Synonym: pseudocumene,pseudocumol,psi-cumene,as-trimethylbenzene,1,3,4-trimethylbenzene,benzene, 1,2,4-trimethyl,uns-trimethylbenzene,1,2,5-trimethylbenzene,asymmetrical trimethylbenzene,.psi.-cumene PubChem CID: 7247 ChEBI: CHEBI:34039 IUPAC Name: 1,2,4-trimethylbenzene SMILES: CC1=CC(=C(C=C1)C)C

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Specifications

PubChem CID	7247
CAS	95-63-6
Molecular Weight (g/mol)	120.195
ChEBI	CHEBI:34039
MDL Number	MFCD00008527
SMILES	CC1=CC(=C(C=C1)C)C
Synonym	pseudocumene,pseudocumol,psi-cumene,as-trimethylbenzene,1,3,4-trimethylbenzene,benzene, 1,2,4-trimethyl,uns-trimethylbenzene,1,2,5-trimethylbenzene,asymmetrical trimethylbenzene,.psi.-cumene
IUPAC Name	1,2,4-trimethylbenzene
InChI Key	GWHJZXXIDMPWGX-UHFFFAOYSA-N
Molecular Formula	C9H12

Dodecylbenzene, mixture of isomers

CAS: 123-01-3 Molecular Formula: C18H30 Molecular Weight (g/mol): 246.438 MDL Number: MFCD00008974 InChI Key: KWKXNDCHNDYVRT-UHFFFAOYSA-N Synonym: 1-phenyldodecane,benzene, dodecyl,n-dodecylbenzene,laurylbenzene,phenyldodecane,marlican,dodecane, 1-phenyl,detergent alkylate,alkylate p 1,phenyldodecan PubChem CID: 31237 IUPAC Name: dodecylbenzene SMILES: CCCCCCCCCCCCC1=CC=CC=C1

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Specifications

PubChem CID	31237
CAS	123-01-3
Molecular Weight (g/mol)	246.438
MDL Number	MFCD00008974
SMILES	CCCCCCCCCCCCC1=CC=CC=C1
Synonym	1-phenyldodecane,benzene, dodecyl,n-dodecylbenzene,laurylbenzene,phenyldodecane,marlican,dodecane, 1-phenyl,detergent alkylate,alkylate p 1,phenyldodecan
IUPAC Name	dodecylbenzene
InChI Key	KWKXNDCHNDYVRT-UHFFFAOYSA-N
Molecular Formula	C18H30

Bis(pentamethylcyclopentadienyl)zirconium dichloride, 99%, Thermo Scientific Chemicals

CAS: 54039-38-2 Molecular Formula: C20H30Cl2Zr-2 Molecular Weight (g/mol): 432.584 MDL Number: MFCD00058849 InChI Key: OCFSLQKTBFSWPL-UHFFFAOYSA-L Synonym: decamethylzirconocene dichloride PubChem CID: 57369741 IUPAC Name: dichlorozirconium;1,2,3,4,5-pentamethylcyclopenta-1,3-diene SMILES: C[C-]1C(=C(C(=C1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.Cl[Zr]Cl

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Specifications

PubChem CID	57369741
CAS	54039-38-2
Molecular Weight (g/mol)	432.584
MDL Number	MFCD00058849
SMILES	C[C-]1C(=C(C(=C1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.Cl[Zr]Cl
Synonym	decamethylzirconocene dichloride
IUPAC Name	dichlorozirconium;1,2,3,4,5-pentamethylcyclopenta-1,3-diene
InChI Key	OCFSLQKTBFSWPL-UHFFFAOYSA-L
Molecular Formula	C20H30Cl2Zr-2

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