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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2-Phenylindene, Thermo Scientific Chemicals

CAS: 4505-48-0 Molecular Formula: C15H12 Molecular Weight (g/mol): 192.26 MDL Number: MFCD00239514 InChI Key: BSBXLZYWGGAVHD-UHFFFAOYSA-N IUPAC Name: 2-phenyl-1H-indene SMILES: C1C2=CC=CC=C2C=C1C1=CC=CC=C1

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CAS	4505-48-0
Molecular Weight (g/mol)	192.26
MDL Number	MFCD00239514
SMILES	C1C2=CC=CC=C2C=C1C1=CC=CC=C1
IUPAC Name	2-phenyl-1H-indene
InChI Key	BSBXLZYWGGAVHD-UHFFFAOYSA-N
Molecular Formula	C15H12

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Bis(cyclopentadienyl)titanium dichloride, 97%

CAS: 1271-19-8 Molecular Formula: C10H10Cl2Ti-2 Molecular Weight (g/mol): 248.957 MDL Number: MFCD00003723 InChI Key: MKNXBRLZBFVUPV-UHFFFAOYSA-L Synonym: Dichlorobis(cyclopentadienyl)titanium; Titanocene dichloride PubChem CID: 124040768 IUPAC Name: cyclopenta-1,3-diene;titanium(2+);dichloride SMILES: [CH-]1C=CC=C1.[CH-]1C=CC=C1.[Cl-].[Cl-].[Ti+2]

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PubChem CID	124040768
CAS	1271-19-8
Molecular Weight (g/mol)	248.957
MDL Number	MFCD00003723
SMILES	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Cl-].[Cl-].[Ti+2]
Synonym	Dichlorobis(cyclopentadienyl)titanium; Titanocene dichloride
IUPAC Name	cyclopenta-1,3-diene;titanium(2+);dichloride
InChI Key	MKNXBRLZBFVUPV-UHFFFAOYSA-L
Molecular Formula	C10H10Cl2Ti-2

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3-Methylbiphenyl, 95%

CAS: 643-93-6 Molecular Formula: C13H12 Molecular Weight (g/mol): 168.239 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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PubChem CID	12564
CAS	643-93-6
Molecular Weight (g/mol)	168.239
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

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n-Octylbenzene, 99%

CAS: 2189-60-8 Molecular Formula: C14H22 Molecular Weight (g/mol): 190.33 MDL Number: MFCD00009564 InChI Key: CDKDZKXSXLNROY-UHFFFAOYSA-N Synonym: n-octylbenzene,1-phenyloctane,benzene, octyl,phenyloctane,octane, 1-phenyl,octyl-benzene,1-octylbenzene,octyl benzene,4-octylbenzene,acmc-1cplg PubChem CID: 16607 IUPAC Name: octylbenzene SMILES: CCCCCCCCC1=CC=CC=C1

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PubChem CID	16607
CAS	2189-60-8
Molecular Weight (g/mol)	190.33
MDL Number	MFCD00009564
SMILES	CCCCCCCCC1=CC=CC=C1
Synonym	n-octylbenzene,1-phenyloctane,benzene, octyl,phenyloctane,octane, 1-phenyl,octyl-benzene,1-octylbenzene,octyl benzene,4-octylbenzene,acmc-1cplg
IUPAC Name	octylbenzene
InChI Key	CDKDZKXSXLNROY-UHFFFAOYSA-N
Molecular Formula	C14H22

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1,3,5-Triethylbenzene, 95%

CAS: 102-25-0 Molecular Formula: C12H18 Molecular Weight (g/mol): 162.28 MDL Number: MFCD00009261 InChI Key: WJYMPXJVHNDZHD-UHFFFAOYSA-N Synonym: benzene, 1,3,5-triethyl,unii-02k328wwzq,1,5-triethylbenzene,pubchem19794,benzene,3,5-triethyl,1,3,5-triethyl benzene,ksc493q9l,wjympxjvhndzhd-uhfffaoysa,1,3,5-triethylbenzene,1,3,5-triethylbenzene, technical grade PubChem CID: 7602 IUPAC Name: 1,3,5-triethylbenzene SMILES: CCC1=CC(CC)=CC(CC)=C1

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PubChem CID	7602
CAS	102-25-0
Molecular Weight (g/mol)	162.28
MDL Number	MFCD00009261
SMILES	CCC1=CC(CC)=CC(CC)=C1
Synonym	benzene, 1,3,5-triethyl,unii-02k328wwzq,1,5-triethylbenzene,pubchem19794,benzene,3,5-triethyl,1,3,5-triethyl benzene,ksc493q9l,wjympxjvhndzhd-uhfffaoysa,1,3,5-triethylbenzene,1,3,5-triethylbenzene, technical grade
IUPAC Name	1,3,5-triethylbenzene
InChI Key	WJYMPXJVHNDZHD-UHFFFAOYSA-N
Molecular Formula	C12H18

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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2-Ethyltoluene, 98+%

CAS: 611-14-3 Molecular Formula: C9H12 Molecular Weight (g/mol): 120.195 MDL Number: MFCD00009257 InChI Key: HYFLWBNQFMXCPA-UHFFFAOYSA-N Synonym: 2-ethyltoluene,o-ethyltoluene,o-methylethylbenzene,1-methyl-2-ethylbenzene,toluene, o-ethyl,ortho-ethyltoluene,benzene, 1-ethyl-2-methyl,1,2-methylethylbenzene,o-ethyl methylbenzene,o-ethyl methyl benzene PubChem CID: 11903 ChEBI: CHEBI:34276 IUPAC Name: 1-ethyl-2-methylbenzene SMILES: CCC1=CC=CC=C1C

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Specifications

PubChem CID	11903
CAS	611-14-3
Molecular Weight (g/mol)	120.195
ChEBI	CHEBI:34276
MDL Number	MFCD00009257
SMILES	CCC1=CC=CC=C1C
Synonym	2-ethyltoluene,o-ethyltoluene,o-methylethylbenzene,1-methyl-2-ethylbenzene,toluene, o-ethyl,ortho-ethyltoluene,benzene, 1-ethyl-2-methyl,1,2-methylethylbenzene,o-ethyl methylbenzene,o-ethyl methyl benzene
IUPAC Name	1-ethyl-2-methylbenzene
InChI Key	HYFLWBNQFMXCPA-UHFFFAOYSA-N
Molecular Formula	C9H12

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1,2,3,4-Tetramethylbenzene, 95%

CAS: 488-23-3 Molecular Formula: C10H14 Molecular Weight (g/mol): 134.222 MDL Number: MFCD00008521 InChI Key: UOHMMEJUHBCKEE-UHFFFAOYSA-N Synonym: prehnitene,prehnitol,benzene, 1,2,3,4-tetramethyl,tetramethylbenzene,unii-96wt7d2wxj,benzene, tetramethyl,96wt7d2wxj,ccris 8659,tetramethylbenzenes,tetra-methyl benzene PubChem CID: 10263 ChEBI: CHEBI:38997 IUPAC Name: 1,2,3,4-tetramethylbenzene SMILES: CC1=C(C(=C(C=C1)C)C)C

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Specifications

PubChem CID	10263
CAS	488-23-3
Molecular Weight (g/mol)	134.222
ChEBI	CHEBI:38997
MDL Number	MFCD00008521
SMILES	CC1=C(C(=C(C=C1)C)C)C
Synonym	prehnitene,prehnitol,benzene, 1,2,3,4-tetramethyl,tetramethylbenzene,unii-96wt7d2wxj,benzene, tetramethyl,96wt7d2wxj,ccris 8659,tetramethylbenzenes,tetra-methyl benzene
IUPAC Name	1,2,3,4-tetramethylbenzene
InChI Key	UOHMMEJUHBCKEE-UHFFFAOYSA-N
Molecular Formula	C10H14

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n-Butylbenzene, 99%

CAS: 104-51-8 Molecular Formula: C10H14 Molecular Weight (g/mol): 134.22 MDL Number: MFCD00009463 InChI Key: OCKPCBLVNKHBMX-UHFFFAOYSA-N Synonym: n-butylbenzene,1-phenylbutane,benzene, butyl,1-butylbenzene,butyl-benzene,butane, phenyl,unii-s8xz2901rz,butylbenzene, analytical standard,n-butyl benzene,n4b PubChem CID: 7705 ChEBI: CHEBI:44194 IUPAC Name: butylbenzene SMILES: CCCCC1=CC=CC=C1

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Specifications

PubChem CID	7705
CAS	104-51-8
Molecular Weight (g/mol)	134.22
ChEBI	CHEBI:44194
MDL Number	MFCD00009463
SMILES	CCCCC1=CC=CC=C1
Synonym	n-butylbenzene,1-phenylbutane,benzene, butyl,1-butylbenzene,butyl-benzene,butane, phenyl,unii-s8xz2901rz,butylbenzene, analytical standard,n-butyl benzene,n4b
IUPAC Name	butylbenzene
InChI Key	OCKPCBLVNKHBMX-UHFFFAOYSA-N
Molecular Formula	C10H14

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Hexamethylbenzene, 99+%

CAS: 87-85-4 Molecular Formula: C12H18 Molecular Weight (g/mol): 162.276 MDL Number: MFCD00008523 InChI Key: YUWFEBAXEOLKSG-UHFFFAOYSA-N Synonym: hexamethylbenzene,mellitene,benzene, hexamethyl,hexamethylbenzol,hexamethyl benzene,unii-j8sd5741v8,1,2,3,4,5,6-hexamethyl-benzene,benzene, 1,2,3,4,5,6-hexamethyl,hexamethyl-benzene,hexamethylbenxene; PubChem CID: 6908 ChEBI: CHEBI:39001 IUPAC Name: 1,2,3,4,5,6-hexamethylbenzene SMILES: CC1=C(C(=C(C(=C1C)C)C)C)C

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Specifications

PubChem CID	6908
CAS	87-85-4
Molecular Weight (g/mol)	162.276
ChEBI	CHEBI:39001
MDL Number	MFCD00008523
SMILES	CC1=C(C(=C(C(=C1C)C)C)C)C
Synonym	hexamethylbenzene,mellitene,benzene, hexamethyl,hexamethylbenzol,hexamethyl benzene,unii-j8sd5741v8,1,2,3,4,5,6-hexamethyl-benzene,benzene, 1,2,3,4,5,6-hexamethyl,hexamethyl-benzene,hexamethylbenxene;
IUPAC Name	1,2,3,4,5,6-hexamethylbenzene
InChI Key	YUWFEBAXEOLKSG-UHFFFAOYSA-N
Molecular Formula	C12H18

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n-Pentylbenzene, 96%

CAS: 538-68-1 Molecular Formula: C11H16 Molecular Weight (g/mol): 148.249 MDL Number: MFCD00009502 InChI Key: PWATWSYOIIXYMA-UHFFFAOYSA-N Synonym: 1-phenylpentane,n-pentylbenzene,amylbenzene,n-amylbenzene,benzene, pentyl,1-pentylbenzene,1-phenyl-n-pentane,pentane, 1-phenyl,pentyl-benzene,pentane, phenyl PubChem CID: 10864 IUPAC Name: pentylbenzene SMILES: CCCCCC1=CC=CC=C1

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Specifications

PubChem CID	10864
CAS	538-68-1
Molecular Weight (g/mol)	148.249
MDL Number	MFCD00009502
SMILES	CCCCCC1=CC=CC=C1
Synonym	1-phenylpentane,n-pentylbenzene,amylbenzene,n-amylbenzene,benzene, pentyl,1-pentylbenzene,1-phenyl-n-pentane,pentane, 1-phenyl,pentyl-benzene,pentane, phenyl
IUPAC Name	pentylbenzene
InChI Key	PWATWSYOIIXYMA-UHFFFAOYSA-N
Molecular Formula	C11H16

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Bis(cyclopentadienyl)titanium dichloride, 97%

CAS: 1271-19-8 Molecular Formula: C₁₀H₁₀Cl₂Ti Molecular Weight (g/mol): 249 MDL Number: MFCD00003723 InChI Key: MKNXBRLZBFVUPV-UHFFFAOYSA-L Synonym: Titanocene dichloride PubChem CID: 124040768 IUPAC Name: cyclopenta-1,3-diene;titanium(2+);dichloride SMILES: [CH-]1C=CC=C1.[CH-]1C=CC=C1.[Cl-].[Cl-].[Ti+2]

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Specifications

PubChem CID	124040768
CAS	1271-19-8
Molecular Weight (g/mol)	249
MDL Number	MFCD00003723
SMILES	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Cl-].[Cl-].[Ti+2]
Synonym	Titanocene dichloride
IUPAC Name	cyclopenta-1,3-diene;titanium(2+);dichloride
InChI Key	MKNXBRLZBFVUPV-UHFFFAOYSA-L
Molecular Formula	C₁₀H₁₀Cl₂Ti

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Biphenyl, 99%

CAS: 92-52-4 Molecular Formula: C12H10 Molecular Weight (g/mol): 154.21 MDL Number: MFCD00003054 InChI Key: ZUOUZKKEUPVFJK-UHFFFAOYSA-N Synonym: biphenyl,phenylbenzene,diphenyl,1,1'-diphenyl,bibenzene,lemonene,xenene,phenador-x,tetrosin ly,carolid al PubChem CID: 7095 ChEBI: CHEBI:17097 IUPAC Name: 1,1'-biphenyl SMILES: C1=CC=C(C=C1)C1=CC=CC=C1

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PubChem CID	7095
CAS	92-52-4
Molecular Weight (g/mol)	154.21
ChEBI	CHEBI:17097
MDL Number	MFCD00003054
SMILES	C1=CC=C(C=C1)C1=CC=CC=C1
Synonym	biphenyl,phenylbenzene,diphenyl,1,1'-diphenyl,bibenzene,lemonene,xenene,phenador-x,tetrosin ly,carolid al
IUPAC Name	1,1'-biphenyl
InChI Key	ZUOUZKKEUPVFJK-UHFFFAOYSA-N
Molecular Formula	C12H10

Benzeneruthenium(II) chloride, dimer, 97%

CAS: 37366-09-9 Molecular Formula: C₁₂H₁₂Cl₄Ru₂ Molecular Weight (g/mol): 500.18 MDL Number: MFCD00064686 InChI Key: YGXMUPKIEHNBNQ-UHFFFAOYSA-J Synonym: benzeneruthenium ii chloride dimer,dibenzenetetrachlorodiruthenium,bis benzene dichlororuthenium,benzene dichlororuthenium dimer,benzeneruthenium dichloride dimer,bis benzene tetrachlorodiruthenium,rucl2 benzene 2,dichloro benzene rutheniumdimer,benzene ruthenium cento chloride PubChem CID: 10962144 IUPAC Name: benzene;dichlororuthenium SMILES: C1=CC=CC=C1.C1=CC=CC=C1.Cl[Ru]Cl.Cl[Ru]Cl

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PubChem CID	10962144
CAS	37366-09-9
Molecular Weight (g/mol)	500.18
MDL Number	MFCD00064686
SMILES	C1=CC=CC=C1.C1=CC=CC=C1.Cl[Ru]Cl.Cl[Ru]Cl
Synonym	benzeneruthenium ii chloride dimer,dibenzenetetrachlorodiruthenium,bis benzene dichlororuthenium,benzene dichlororuthenium dimer,benzeneruthenium dichloride dimer,bis benzene tetrachlorodiruthenium,rucl2 benzene 2,dichloro benzene rutheniumdimer,benzene ruthenium cento chloride
IUPAC Name	benzene;dichlororuthenium
InChI Key	YGXMUPKIEHNBNQ-UHFFFAOYSA-J
Molecular Formula	C₁₂H₁₂Cl₄Ru₂

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1,2,4-Trimethylbenzene, 98%

CAS: 95-63-6 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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PubChem CID	7247
CAS	95-63-6
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

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