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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Hexaphenylbenzene, 98+%

CAS: 992-04-1 Molecular Formula: C42H30 Molecular Weight (g/mol): 534.702 MDL Number: MFCD00003057 InChI Key: QBHWPVJPWQGYDS-UHFFFAOYSA-N Synonym: hexaphenylbenzene,benzene, hexaphenyl,3',4',5',6'-tetraphenyl-o-terphenyl,acmc-20akri,m-terphenyl, 2',4',5',6'-tetraphenyl,ghl.pd_mitscher_leg0.890,hexaphenylbenzene 1g,1,1':2',1-terphenyl, 3',4',5',6'-tetraphenyl,1,2,3,4,5,6-hexaphenylbenzene PubChem CID: 70432 IUPAC Name: 1,2,3,4,5,6-hexakis-phenylbenzene SMILES: C1=CC=C(C=C1)C2=C(C(=C(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7

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PubChem CID	70432
CAS	992-04-1
Molecular Weight (g/mol)	534.702
MDL Number	MFCD00003057
SMILES	C1=CC=C(C=C1)C2=C(C(=C(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7
Synonym	hexaphenylbenzene,benzene, hexaphenyl,3',4',5',6'-tetraphenyl-o-terphenyl,acmc-20akri,m-terphenyl, 2',4',5',6'-tetraphenyl,ghl.pd_mitscher_leg0.890,hexaphenylbenzene 1g,1,1':2',1-terphenyl, 3',4',5',6'-tetraphenyl,1,2,3,4,5,6-hexaphenylbenzene
IUPAC Name	1,2,3,4,5,6-hexakis-phenylbenzene
InChI Key	QBHWPVJPWQGYDS-UHFFFAOYSA-N
Molecular Formula	C42H30

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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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

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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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

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

Hexamethylbenzene, 98+%

CAS: 87-85-4 Molecular Formula: C₁₂H₁₈ Molecular Weight (g/mol): 162.27 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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PubChem CID	6908
CAS	87-85-4
Molecular Weight (g/mol)	162.27
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

Ethylbenzene, 99.8%, pure

CAS: 100-41-4 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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PubChem CID	7500
CAS	100-41-4
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

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

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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Specifications

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

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

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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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

Mesitylene, 97%, pure

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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

1,2-Diethylbenzene, 97%

CAS: 135-01-3 Molecular Formula: C10H14 Molecular Weight (g/mol): 134.222 MDL Number: MFCD00009258 InChI Key: KVNYFPKFSJIPBJ-UHFFFAOYSA-N Synonym: o-diethylbenzene,benzene, 1,2-diethyl,benzene, diethyl,benzene, o-diethyl,diethylbenzol,unii-25hox6t1lu,25hox6t1lu,diethylbenzenes mixed isomer,dsstox_cid_7866,dsstox_rid_78595 PubChem CID: 8657 IUPAC Name: 1,2-diethylbenzene SMILES: CCC1=CC=CC=C1CC

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PubChem CID	8657
CAS	135-01-3
Molecular Weight (g/mol)	134.222
MDL Number	MFCD00009258
SMILES	CCC1=CC=CC=C1CC
Synonym	o-diethylbenzene,benzene, 1,2-diethyl,benzene, diethyl,benzene, o-diethyl,diethylbenzol,unii-25hox6t1lu,25hox6t1lu,diethylbenzenes mixed isomer,dsstox_cid_7866,dsstox_rid_78595
IUPAC Name	1,2-diethylbenzene
InChI Key	KVNYFPKFSJIPBJ-UHFFFAOYSA-N
Molecular Formula	C10H14

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

CAS: 95-93-2 Molecular Formula: C₁₀H₁₄ Molecular Weight (g/mol): 134.22 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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Specifications

PubChem CID	7269
CAS	95-93-2
Molecular Weight (g/mol)	134.22
ChEBI	CHEBI:38978
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

Cyclohexylbenzene, 98%

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

Aromatic hydrocarbons

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