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

(Pentamethylcyclopentadienyl)iridium(III) Chloride dimer, 99%

CAS: 12354-84-6 Molecular Formula: C₂₀H₃₀Cl₄Ir₂ Molecular Weight (g/mol): 796.73 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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PubChem CID	76030743
CAS	12354-84-6
Molecular Weight (g/mol)	796.73
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

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1,2-Di(p-tolyl)ethane, 98%

CAS: 538-39-6 Molecular Formula: C16H18 Molecular Weight (g/mol): 210.32 MDL Number: MFCD00026025 InChI Key: XCCQFUHBIRHLQT-UHFFFAOYSA-N Synonym: 1,2-di p-tolyl ethane,4,4'-dimethylbibenzyl,1,2-di-p-tolylethane,unii-ua2zyh96ih,bibenzyl, 4,4'-dimethyl,1-methyl-4-2-4-methylphenyl ethyl benzene,ua2zyh96ih,1,2-bis 4-methylphenyl ethane,benzene, 1,1'-1,2-ethanediyl bis 4-methyl PubChem CID: 10854 IUPAC Name: 1-methyl-4-[2-(4-methylphenyl)ethyl]benzene SMILES: CC1=CC=C(C=C1)CCC2=CC=C(C=C2)C

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Specifications

PubChem CID	10854
CAS	538-39-6
Molecular Weight (g/mol)	210.32
MDL Number	MFCD00026025
SMILES	CC1=CC=C(C=C1)CCC2=CC=C(C=C2)C
Synonym	1,2-di p-tolyl ethane,4,4'-dimethylbibenzyl,1,2-di-p-tolylethane,unii-ua2zyh96ih,bibenzyl, 4,4'-dimethyl,1-methyl-4-2-4-methylphenyl ethyl benzene,ua2zyh96ih,1,2-bis 4-methylphenyl ethane,benzene, 1,1'-1,2-ethanediyl bis 4-methyl
IUPAC Name	1-methyl-4-[2-(4-methylphenyl)ethyl]benzene
InChI Key	XCCQFUHBIRHLQT-UHFFFAOYSA-N
Molecular Formula	C16H18

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n-Tetradecylbenzene, 97%

CAS: 1459-10-5 Molecular Formula: C20H34 Molecular Weight (g/mol): 274.492 MDL Number: MFCD00015080 InChI Key: JZALLXAUNPOCEU-UHFFFAOYSA-N Synonym: 1-phenyltetradecane,benzene, tetradecyl,1-tetradecylbenzene,tetradecane, 1-phenyl,myristylbenzene,n-tetradecylbenzene,unii-i0y9j0o95a,phenyl-n-tetradecane,acmc-209cvz,1-phenyltetradecane, analytical standard PubChem CID: 15086 IUPAC Name: tetradecylbenzene SMILES: CCCCCCCCCCCCCCC1=CC=CC=C1

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Specifications

PubChem CID	15086
CAS	1459-10-5
Molecular Weight (g/mol)	274.492
MDL Number	MFCD00015080
SMILES	CCCCCCCCCCCCCCC1=CC=CC=C1
Synonym	1-phenyltetradecane,benzene, tetradecyl,1-tetradecylbenzene,tetradecane, 1-phenyl,myristylbenzene,n-tetradecylbenzene,unii-i0y9j0o95a,phenyl-n-tetradecane,acmc-209cvz,1-phenyltetradecane, analytical standard
IUPAC Name	tetradecylbenzene
InChI Key	JZALLXAUNPOCEU-UHFFFAOYSA-N
Molecular Formula	C20H34

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n-Dodecylbenzene, 97%

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

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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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Pentamethylbenzene, 99%

CAS: 700-12-9 Molecular Formula: C11H16 Molecular Weight (g/mol): 148.249 MDL Number: MFCD00008522 InChI Key: BEZDDPMMPIDMGJ-UHFFFAOYSA-N Synonym: pentamethylbenzene,benzene, pentamethyl,pentamethylbenzol,benzene, 1,2,3,4,5-pentamethyl,pentamethyl phenyl,acmc-1bkt8,ksc492e3d,1,3,4,5-pentamethylbenzene,pentamethylbenzene 5g PubChem CID: 12784 ChEBI: CHEBI:38998 IUPAC Name: 1,2,3,4,5-pentamethylbenzene SMILES: CC1=CC(=C(C(=C1C)C)C)C

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Specifications

PubChem CID	12784
CAS	700-12-9
Molecular Weight (g/mol)	148.249
ChEBI	CHEBI:38998
MDL Number	MFCD00008522
SMILES	CC1=CC(=C(C(=C1C)C)C)C
Synonym	pentamethylbenzene,benzene, pentamethyl,pentamethylbenzol,benzene, 1,2,3,4,5-pentamethyl,pentamethyl phenyl,acmc-1bkt8,ksc492e3d,1,3,4,5-pentamethylbenzene,pentamethylbenzene 5g
IUPAC Name	1,2,3,4,5-pentamethylbenzene
InChI Key	BEZDDPMMPIDMGJ-UHFFFAOYSA-N
Molecular Formula	C11H16

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2-Phenylpentane, tech. 85%

CAS: 2719-52-0 Molecular Formula: C11H16 Molecular Weight (g/mol): 148.25 MDL Number: MFCD00027145 InChI Key: LTHAIAJHDPJXLG-UHFFFAOYNA-N Synonym: 2-phenylpentane,sec-pentylbenzene,benzene, sec-pentyl,sec-amylbenzene,benzene, 1-methylbutyl,1-phenyl-1-methylbutane,s-amylbenzene,d-2-phenyl-pentane,sec-amyl benzene,methylbutyl benzene PubChem CID: 17627 IUPAC Name: pentan-2-ylbenzene SMILES: CCCC(C)C1=CC=CC=C1

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Specifications

PubChem CID	17627
CAS	2719-52-0
Molecular Weight (g/mol)	148.25
MDL Number	MFCD00027145
SMILES	CCCC(C)C1=CC=CC=C1
Synonym	2-phenylpentane,sec-pentylbenzene,benzene, sec-pentyl,sec-amylbenzene,benzene, 1-methylbutyl,1-phenyl-1-methylbutane,s-amylbenzene,d-2-phenyl-pentane,sec-amyl benzene,methylbutyl benzene
IUPAC Name	pentan-2-ylbenzene
InChI Key	LTHAIAJHDPJXLG-UHFFFAOYNA-N
Molecular Formula	C11H16

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1,4-Diethylbenzene, 98%

CAS: 105-05-5 Molecular Formula: C10H14 Molecular Weight (g/mol): 134.22 MDL Number: MFCD00009264 InChI Key: DSNHSQKRULAAEI-UHFFFAOYSA-N Synonym: p-diethylbenzene,benzene, 1,4-diethyl,p-ethylethylbenzene,benzene, p-diethyl,para-diethylbenzene,unii-0psm16x42d,acmc-1bu3z,dsstox_cid_6711,dsstox_rid_78192,dsstox_gsid_26711 PubChem CID: 7734 ChEBI: CHEBI:34062 IUPAC Name: 1,4-diethylbenzene SMILES: CCC1=CC=C(CC)C=C1

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Specifications

PubChem CID	7734
CAS	105-05-5
Molecular Weight (g/mol)	134.22
ChEBI	CHEBI:34062
MDL Number	MFCD00009264
SMILES	CCC1=CC=C(CC)C=C1
Synonym	p-diethylbenzene,benzene, 1,4-diethyl,p-ethylethylbenzene,benzene, p-diethyl,para-diethylbenzene,unii-0psm16x42d,acmc-1bu3z,dsstox_cid_6711,dsstox_rid_78192,dsstox_gsid_26711
IUPAC Name	1,4-diethylbenzene
InChI Key	DSNHSQKRULAAEI-UHFFFAOYSA-N
Molecular Formula	C10H14

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1-Phenyloctane, 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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Specifications

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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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

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4,4'-Dimethylbiphenyl, 99%

CAS: 613-33-2 Molecular Formula: C14H14 Molecular Weight (g/mol): 182.266 MDL Number: MFCD00008545 InChI Key: RZTDESRVPFKCBH-UHFFFAOYSA-N Synonym: 4,4'-dimethylbiphenyl,4,4'-bitolyl,4,4'-dimethyldiphenyl,bi-p-tolyl,di-p-tolyl,p,p'-bitolyl,4,4'-dimethyl-1,1'-biphenyl,4,4'-ditolyl,1,1'-biphenyl, 4,4'-dimethyl,4,4'-dimethyl-biphenyl PubChem CID: 11941 IUPAC Name: 1-methyl-4-(4-methylphenyl)benzene SMILES: CC1=CC=C(C=C1)C2=CC=C(C=C2)C

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Specifications

PubChem CID	11941
CAS	613-33-2
Molecular Weight (g/mol)	182.266
MDL Number	MFCD00008545
SMILES	CC1=CC=C(C=C1)C2=CC=C(C=C2)C
Synonym	4,4'-dimethylbiphenyl,4,4'-bitolyl,4,4'-dimethyldiphenyl,bi-p-tolyl,di-p-tolyl,p,p'-bitolyl,4,4'-dimethyl-1,1'-biphenyl,4,4'-ditolyl,1,1'-biphenyl, 4,4'-dimethyl,4,4'-dimethyl-biphenyl
IUPAC Name	1-methyl-4-(4-methylphenyl)benzene
InChI Key	RZTDESRVPFKCBH-UHFFFAOYSA-N
Molecular Formula	C14H14

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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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Specifications

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

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

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

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