Benzene and substituted derivatives

Benzene is an aromatic organic molecule composed of six carbon atoms and six hydrogen atoms that form a ring. Includes substituted derivative compounds.

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6,886 – 6,900 of 77,581 results

6,886

5,8-Dibromo-2,3-bis(4-methoxyphenyl)quinoxaline 98.0+%, TCI America™

CAS: 162967-90-0 Molecular Formula: C22H16Br2N2O2 Molecular Weight (g/mol): 500.19 InChI Key: PEHOANSJGUIQOF-UHFFFAOYSA-N PubChem CID: 57712549 IUPAC Name: 5,8-dibromo-2,3-bis(4-methoxyphenyl)quinoxaline SMILES: COC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3N=C2C4=CC=C(C=C4)OC)Br)Br

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Specifications

PubChem CID	57712549
CAS	162967-90-0
Molecular Weight (g/mol)	500.19
SMILES	COC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3N=C2C4=CC=C(C=C4)OC)Br)Br
IUPAC Name	5,8-dibromo-2,3-bis(4-methoxyphenyl)quinoxaline
InChI Key	PEHOANSJGUIQOF-UHFFFAOYSA-N
Molecular Formula	C22H16Br2N2O2

6,887

1-Ethyl-4-[(4-methoxyphenyl)ethynyl]benzene 98.0+%, TCI America™

CAS: 63221-88-5 Molecular Formula: C17H16O Molecular Weight (g/mol): 236.31 MDL Number: MFCD00807428 InChI Key: YWDALJMLXXWXFP-UHFFFAOYSA-N Synonym: 1-ethyl-4-4-methoxyphenyl ethynyl benzene,1-4-ethylphenyl-2-4-methoxyphenyl acetylene,4-4-ethylphenyl ethynyl anisole,1-ethyl-4-2-4-methoxyphenyl ethynyl benzene,benzene,1-ethyl-4-2-4-methoxyphenyl ethynyl,1-2-4-ethylphenyl ethynyl-4-methoxybenzene,4-methoxy-4'-ethyltolane,acmc-209ne1 PubChem CID: 3952083 IUPAC Name: 1-ethyl-4-[2-(4-methoxyphenyl)ethynyl]benzene SMILES: CCC1=CC=C(C=C1)C#CC1=CC=C(OC)C=C1

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Specifications

PubChem CID	3952083
CAS	63221-88-5
Molecular Weight (g/mol)	236.31
MDL Number	MFCD00807428
SMILES	CCC1=CC=C(C=C1)C#CC1=CC=C(OC)C=C1
Synonym	1-ethyl-4-4-methoxyphenyl ethynyl benzene,1-4-ethylphenyl-2-4-methoxyphenyl acetylene,4-4-ethylphenyl ethynyl anisole,1-ethyl-4-2-4-methoxyphenyl ethynyl benzene,benzene,1-ethyl-4-2-4-methoxyphenyl ethynyl,1-2-4-ethylphenyl ethynyl-4-methoxybenzene,4-methoxy-4'-ethyltolane,acmc-209ne1
IUPAC Name	1-ethyl-4-[2-(4-methoxyphenyl)ethynyl]benzene
InChI Key	YWDALJMLXXWXFP-UHFFFAOYSA-N
Molecular Formula	C17H16O

6,888

4-Hydroxy-4'-methoxybiphenyl 95.0+%, TCI America™

CAS: 16881-71-3 Molecular Formula: C13H12O2 Molecular Weight (g/mol): 200.237 MDL Number: MFCD00191514 InChI Key: CORJIEYQXMZUIW-UHFFFAOYSA-N PubChem CID: 11030839 IUPAC Name: 4-(4-methoxyphenyl)phenol SMILES: COC1=CC=C(C=C1)C2=CC=C(C=C2)O

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Specifications

PubChem CID	11030839
CAS	16881-71-3
Molecular Weight (g/mol)	200.237
MDL Number	MFCD00191514
SMILES	COC1=CC=C(C=C1)C2=CC=C(C=C2)O
IUPAC Name	4-(4-methoxyphenyl)phenol
InChI Key	CORJIEYQXMZUIW-UHFFFAOYSA-N
Molecular Formula	C13H12O2

6,889

4-Methoxyphenylacetic Anhydride 98.0+%, TCI America™

CAS: 3951-10-8 Molecular Formula: C18H18O5 Molecular Weight (g/mol): 314.34 MDL Number: MFCD00059089 InChI Key: KYCAEIXHUXBNTQ-UHFFFAOYSA-N PubChem CID: 14086930 IUPAC Name: [2-(4-methoxyphenyl)acetyl] 2-(4-methoxyphenyl)acetate SMILES: COC1=CC=C(C=C1)CC(=O)OC(=O)CC2=CC=C(C=C2)OC

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Specifications

PubChem CID	14086930
CAS	3951-10-8
Molecular Weight (g/mol)	314.34
MDL Number	MFCD00059089
SMILES	COC1=CC=C(C=C1)CC(=O)OC(=O)CC2=CC=C(C=C2)OC
IUPAC Name	[2-(4-methoxyphenyl)acetyl] 2-(4-methoxyphenyl)acetate
InChI Key	KYCAEIXHUXBNTQ-UHFFFAOYSA-N
Molecular Formula	C18H18O5

6,890

3-Methoxytoluene 98.0+%, TCI America™

CAS: 100-84-5 Molecular Formula: C8H10O Molecular Weight (g/mol): 122.17 MDL Number: MFCD00008395 InChI Key: OSIGJGFTADMDOB-UHFFFAOYSA-N Synonym: 3-methylanisole,3-methoxytoluene,m-methylanisole,m-cresol methyl ether,m-methoxytoluene,benzene, 1-methoxy-3-methyl,anisole, m-methyl,methyl m-tolyl ether,m-cresyl methyl ether,methyl m-cresyl ether PubChem CID: 7530 IUPAC Name: 1-methoxy-3-methylbenzene SMILES: COC1=CC=CC(C)=C1

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Specifications

PubChem CID	7530
CAS	100-84-5
Molecular Weight (g/mol)	122.17
MDL Number	MFCD00008395
SMILES	COC1=CC=CC(C)=C1
Synonym	3-methylanisole,3-methoxytoluene,m-methylanisole,m-cresol methyl ether,m-methoxytoluene,benzene, 1-methoxy-3-methyl,anisole, m-methyl,methyl m-tolyl ether,m-cresyl methyl ether,methyl m-cresyl ether
IUPAC Name	1-methoxy-3-methylbenzene
InChI Key	OSIGJGFTADMDOB-UHFFFAOYSA-N
Molecular Formula	C8H10O

6,891

3-Bromo-4-methoxybenzonitrile 98.0+%, TCI America™

CAS: 117572-79-9 Molecular Formula: C8H6BrNO Molecular Weight (g/mol): 212.05 MDL Number: MFCD00143097 InChI Key: QHWZMDRKTYTPEE-UHFFFAOYSA-N Synonym: 2-bromo-4-cyanoanisole,3-bromo-4-methoxylbenzonitrile,3-bromo-4-methoxybenzenecarbonitrile,3-bromo-4-methoxy-benzonitrile,benzonitrile, 3-bromo-4-methoxy,pubchem3795,acmc-1cexj,maybridge4_001971,3-bromo4-methoxybenzonitrile,ksc494m8l PubChem CID: 736049 IUPAC Name: 3-bromo-4-methoxybenzonitrile SMILES: COC1=CC=C(C=C1Br)C#N

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Specifications

PubChem CID	736049
CAS	117572-79-9
Molecular Weight (g/mol)	212.05
MDL Number	MFCD00143097
SMILES	COC1=CC=C(C=C1Br)C#N
Synonym	2-bromo-4-cyanoanisole,3-bromo-4-methoxylbenzonitrile,3-bromo-4-methoxybenzenecarbonitrile,3-bromo-4-methoxy-benzonitrile,benzonitrile, 3-bromo-4-methoxy,pubchem3795,acmc-1cexj,maybridge4_001971,3-bromo4-methoxybenzonitrile,ksc494m8l
IUPAC Name	3-bromo-4-methoxybenzonitrile
InChI Key	QHWZMDRKTYTPEE-UHFFFAOYSA-N
Molecular Formula	C8H6BrNO

6,892

2-Bromo-5-fluoroanisole 95.0+%, TCI America™

CAS: 450-88-4 Molecular Formula: C7H6BrFO Molecular Weight (g/mol): 205.03 MDL Number: MFCD04973752 InChI Key: KGYXKRGMSUHYCY-UHFFFAOYSA-N Synonym: 2-bromo-5-fluoroanisole,benzene, 1-bromo-4-fluoro-2-methoxy,1-bromo-4-fluoro-2-methoxy-benzene,2-methoxy-4-fluorobromobenzene,buttpark 87\07-62,pubchem4091,acmc-1ct2m,ksc494a1p,bromo-4-fluoro-2-methoxybenzene PubChem CID: 7018043 IUPAC Name: 1-bromo-4-fluoro-2-methoxybenzene SMILES: COC1=CC(F)=CC=C1Br

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Specifications

PubChem CID	7018043
CAS	450-88-4
Molecular Weight (g/mol)	205.03
MDL Number	MFCD04973752
SMILES	COC1=CC(F)=CC=C1Br
Synonym	2-bromo-5-fluoroanisole,benzene, 1-bromo-4-fluoro-2-methoxy,1-bromo-4-fluoro-2-methoxy-benzene,2-methoxy-4-fluorobromobenzene,buttpark 87\07-62,pubchem4091,acmc-1ct2m,ksc494a1p,bromo-4-fluoro-2-methoxybenzene
IUPAC Name	1-bromo-4-fluoro-2-methoxybenzene
InChI Key	KGYXKRGMSUHYCY-UHFFFAOYSA-N
Molecular Formula	C7H6BrFO

6,893

4-Benzyloxy-3-methoxyphenylacetic Acid 98.0+%, TCI America™

CAS: 29973-91-9 Molecular Formula: C16H16O4 Molecular Weight (g/mol): 272.3 MDL Number: MFCD00185562 InChI Key: AYCIHUSEBJLTBF-UHFFFAOYSA-N PubChem CID: 297964 IUPAC Name: 2-(3-methoxy-4-phenylmethoxyphenyl)acetic acid SMILES: COC1=C(C=CC(=C1)CC(=O)O)OCC2=CC=CC=C2

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Specifications

PubChem CID	297964
CAS	29973-91-9
Molecular Weight (g/mol)	272.3
MDL Number	MFCD00185562
SMILES	COC1=C(C=CC(=C1)CC(=O)O)OCC2=CC=CC=C2
IUPAC Name	2-(3-methoxy-4-phenylmethoxyphenyl)acetic acid
InChI Key	AYCIHUSEBJLTBF-UHFFFAOYSA-N
Molecular Formula	C16H16O4

6,894

3-Chloro-4-methoxyphenylacetic Acid 97.0+%, TCI America™

CAS: 13721-20-5 Molecular Formula: C9H9ClO3 Molecular Weight (g/mol): 200.62 MDL Number: MFCD02664697 InChI Key: OARWXDXELDVNOC-UHFFFAOYSA-N PubChem CID: 4681662 IUPAC Name: 2-(3-chloro-4-methoxyphenyl)acetic acid SMILES: COC1=C(Cl)C=C(CC(O)=O)C=C1

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PubChem CID	4681662
CAS	13721-20-5
Molecular Weight (g/mol)	200.62
MDL Number	MFCD02664697
SMILES	COC1=C(Cl)C=C(CC(O)=O)C=C1
IUPAC Name	2-(3-chloro-4-methoxyphenyl)acetic acid
InChI Key	OARWXDXELDVNOC-UHFFFAOYSA-N
Molecular Formula	C9H9ClO3

6,895

4-Ethylanisole 98.0+%, TCI America™

CAS: 1515-95-3 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.194 MDL Number: MFCD00015176 InChI Key: HDNRAPAFJLXKBV-UHFFFAOYSA-N Synonym: 4-ethylanisole,p-ethylanisole,benzene, 1-ethyl-4-methoxy,anisole, p-ethyl,p-ethylanisol,unii-i71p5qg20s,4-ethyl-1-methoxybenzene,4-ethyl anisole,4-ethylmethoxybenzene,acmc-1btzv PubChem CID: 73690 IUPAC Name: 1-ethyl-4-methoxybenzene SMILES: CCC1=CC=C(C=C1)OC

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Specifications

PubChem CID	73690
CAS	1515-95-3
Molecular Weight (g/mol)	136.194
MDL Number	MFCD00015176
SMILES	CCC1=CC=C(C=C1)OC
Synonym	4-ethylanisole,p-ethylanisole,benzene, 1-ethyl-4-methoxy,anisole, p-ethyl,p-ethylanisol,unii-i71p5qg20s,4-ethyl-1-methoxybenzene,4-ethyl anisole,4-ethylmethoxybenzene,acmc-1btzv
IUPAC Name	1-ethyl-4-methoxybenzene
InChI Key	HDNRAPAFJLXKBV-UHFFFAOYSA-N
Molecular Formula	C9H12O

6,896

1-Phenyl-2-propanol 98.0+%, TCI America™

CAS: 698-87-3 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.19 MDL Number: MFCD00004540 InChI Key: WYTRYIUQUDTGSX-UHFFFAOYNA-N Synonym: Benzylmethylcarbinol PubChem CID: 94185 IUPAC Name: 1-phenylpropan-2-ol SMILES: CC(O)CC1=CC=CC=C1

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PubChem CID	94185
CAS	698-87-3
Molecular Weight (g/mol)	136.19
MDL Number	MFCD00004540
SMILES	CC(O)CC1=CC=CC=C1
Synonym	Benzylmethylcarbinol
IUPAC Name	1-phenylpropan-2-ol
InChI Key	WYTRYIUQUDTGSX-UHFFFAOYNA-N
Molecular Formula	C9H12O

6,897

Diamyl Phthalate 98.0+%, TCI America™

CAS: 131-18-0 Molecular Formula: C18H26O4 Molecular Weight (g/mol): 306.402 MDL Number: MFCD00041934 InChI Key: IPKKHRVROFYTEK-UHFFFAOYSA-N Synonym: dipentyl phthalate,di-n-pentyl phthalate,diamyl phthalate,amyl phthalate,amoil,di-n-amyl phthalate,di-n-pentylphthalate,phthalic acid, dipentyl ester,phthalic acid diamyl ester,1,2-benzenedicarboxylic acid, dipentyl ester PubChem CID: 8561 ChEBI: CHEBI:34680 IUPAC Name: dipentyl benzene-1,2-dicarboxylate SMILES: CCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCC

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Specifications

PubChem CID	8561
CAS	131-18-0
Molecular Weight (g/mol)	306.402
ChEBI	CHEBI:34680
MDL Number	MFCD00041934
SMILES	CCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCC
Synonym	dipentyl phthalate,di-n-pentyl phthalate,diamyl phthalate,amyl phthalate,amoil,di-n-amyl phthalate,di-n-pentylphthalate,phthalic acid, dipentyl ester,phthalic acid diamyl ester,1,2-benzenedicarboxylic acid, dipentyl ester
IUPAC Name	dipentyl benzene-1,2-dicarboxylate
InChI Key	IPKKHRVROFYTEK-UHFFFAOYSA-N
Molecular Formula	C18H26O4

6,898

2-Phenoxypropionic Acid 98.0+%, TCI America™

CAS: 940-31-8 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00002643 InChI Key: SXERGJJQSKIUIC-UHFFFAOYSA-N Synonym: 2-phenoxypropionic acid,alpha-methylphenoxyacetic acid,propanoic acid, 2-phenoxy,alpha-phenoxypropionic acid,phenoxypropionic acid,acide phenoxy-2-propionique,propionic acid, 2-phenoxy,dl-2-phenoxypropionic acid,2rs-2-phenoxypropionic acid,acide phenoxy-2-propionique french PubChem CID: 13658 IUPAC Name: 2-phenoxypropanoic acid SMILES: CC(C(=O)O)OC1=CC=CC=C1

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Specifications

PubChem CID	13658
CAS	940-31-8
Molecular Weight (g/mol)	166.176
MDL Number	MFCD00002643
SMILES	CC(C(=O)O)OC1=CC=CC=C1
Synonym	2-phenoxypropionic acid,alpha-methylphenoxyacetic acid,propanoic acid, 2-phenoxy,alpha-phenoxypropionic acid,phenoxypropionic acid,acide phenoxy-2-propionique,propionic acid, 2-phenoxy,dl-2-phenoxypropionic acid,2rs-2-phenoxypropionic acid,acide phenoxy-2-propionique french
IUPAC Name	2-phenoxypropanoic acid
InChI Key	SXERGJJQSKIUIC-UHFFFAOYSA-N
Molecular Formula	C9H10O3

6,899

4-Methoxybenzyl Alcohol 98.0+%, TCI America™

CAS: 105-13-5 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.17 MDL Number: MFCD00004653 InChI Key: MSHFRERJPWKJFX-UHFFFAOYSA-N Synonym: 4-methoxybenzyl alcohol,4-methoxyphenyl methanol,anise alcohol,anisyl alcohol,p-anisyl alcohol,p-methoxybenzyl alcohol,benzenemethanol, 4-methoxy,anisic alcohol,p-anisol alcohol,4-methoxybenzenemethanol PubChem CID: 7738 ChEBI: CHEBI:86918 IUPAC Name: (4-methoxyphenyl)methanol SMILES: COC1=CC=C(CO)C=C1

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Specifications

PubChem CID	7738
CAS	105-13-5
Molecular Weight (g/mol)	138.17
ChEBI	CHEBI:86918
MDL Number	MFCD00004653
SMILES	COC1=CC=C(CO)C=C1
Synonym	4-methoxybenzyl alcohol,4-methoxyphenyl methanol,anise alcohol,anisyl alcohol,p-anisyl alcohol,p-methoxybenzyl alcohol,benzenemethanol, 4-methoxy,anisic alcohol,p-anisol alcohol,4-methoxybenzenemethanol
IUPAC Name	(4-methoxyphenyl)methanol
InChI Key	MSHFRERJPWKJFX-UHFFFAOYSA-N
Molecular Formula	C8H10O2

6,900

1-Bromo-2-iodobenzene (stabilized with Copper chip) 98.0+%, TCI America™

CAS: 583-55-1 Molecular Formula: C6H4BrI Molecular Weight (g/mol): 282.906 MDL Number: MFCD00001030 InChI Key: OIRHKGBNGGSCGS-UHFFFAOYSA-N Synonym: 2-bromoiodobenzene,o-bromoiodobenzene,2-bromo-iodobenzene,benzene, 1-bromo-2-iodo,bromoiodobenzene,1-bromo-2-iodo-benzene,attercop-chm at127403,chemwish ic03500,iodobromobenzene,2-iodobromobenzene PubChem CID: 11415 IUPAC Name: 1-bromo-2-iodobenzene SMILES: C1=CC=C(C(=C1)Br)I

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Specifications

PubChem CID	11415
CAS	583-55-1
Molecular Weight (g/mol)	282.906
MDL Number	MFCD00001030
SMILES	C1=CC=C(C(=C1)Br)I
Synonym	2-bromoiodobenzene,o-bromoiodobenzene,2-bromo-iodobenzene,benzene, 1-bromo-2-iodo,bromoiodobenzene,1-bromo-2-iodo-benzene,attercop-chm at127403,chemwish ic03500,iodobromobenzene,2-iodobromobenzene
IUPAC Name	1-bromo-2-iodobenzene
InChI Key	OIRHKGBNGGSCGS-UHFFFAOYSA-N
Molecular Formula	C6H4BrI

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