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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1,786 – 1,800 of 64,662 results

1,786

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3-(2-Methoxyphenyl)-1H-pyrazole, 97%

CAS: 59843-63-9 Molecular Formula: C10H10N2O Molecular Weight (g/mol): 174.203 MDL Number: MFCD02091524 InChI Key: KLPGJCMICASHKV-UHFFFAOYSA-N Synonym: 3-2-methoxyphenyl-1h-pyrazole,5-2-methoxyphenyl-1h-pyrazole,1h-pyrazole, 3-2-methoxyphenyl,3-2-methoxy-phenyl-1h-pyrazole,3-2-methoxyphenyl pyrazole,2-1h-pyrazol-3-yl anisole,2-methoxy-1-pyrazol-3-ylbenzene PubChem CID: 2736764 IUPAC Name: 5-(2-methoxyphenyl)-1H-pyrazole SMILES: COC1=CC=CC=C1C2=CC=NN2

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Specifications

PubChem CID	2736764
CAS	59843-63-9
Molecular Weight (g/mol)	174.203
MDL Number	MFCD02091524
SMILES	COC1=CC=CC=C1C2=CC=NN2
Synonym	3-2-methoxyphenyl-1h-pyrazole,5-2-methoxyphenyl-1h-pyrazole,1h-pyrazole, 3-2-methoxyphenyl,3-2-methoxy-phenyl-1h-pyrazole,3-2-methoxyphenyl pyrazole,2-1h-pyrazol-3-yl anisole,2-methoxy-1-pyrazol-3-ylbenzene
IUPAC Name	5-(2-methoxyphenyl)-1H-pyrazole
InChI Key	KLPGJCMICASHKV-UHFFFAOYSA-N
Molecular Formula	C10H10N2O

1,787

Anisole, ReagentPlus™, 99%, Solstice

CAS: 100-66-3 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00008354 InChI Key: RDOXTESZEPMUJZ-UHFFFAOYSA-N Synonym: methoxybenzene,methyl phenyl ether,benzene, methoxy,anisol,phenyl methyl ether,phenoxymethane,anizol,phenol methyl ether,methoxy-benzene PubChem CID: 7519 ChEBI: CHEBI:16579 IUPAC Name: anisole SMILES: COC1=CC=CC=C1

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Specifications

PubChem CID	7519
CAS	100-66-3
Molecular Weight (g/mol)	108.14
ChEBI	CHEBI:16579
MDL Number	MFCD00008354
SMILES	COC1=CC=CC=C1
Synonym	methoxybenzene,methyl phenyl ether,benzene, methoxy,anisol,phenyl methyl ether,phenoxymethane,anizol,phenol methyl ether,methoxy-benzene
IUPAC Name	anisole
InChI Key	RDOXTESZEPMUJZ-UHFFFAOYSA-N
Molecular Formula	C7H8O

1,788

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3-Bromoanisole, 99+%

CAS: 2398-37-0 Molecular Formula: C7H7BrO Molecular Weight (g/mol): 187.04 MDL Number: MFCD00000081 InChI Key: PLDWAJLZAAHOGG-UHFFFAOYSA-N Synonym: 3-bromoanisole,m-bromoanisole,3-methoxybromobenzene,3-bromo anisole,m-bromomethoxybenzene,benzene, 1-bromo-3-methoxy,anisole, m-bromo,3-methoxy-1-bromobenzene,m-methoxybromobenzene,meta-bromoanisole PubChem CID: 16971 IUPAC Name: 1-bromo-3-methoxybenzene SMILES: COC1=CC=CC(Br)=C1

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Specifications

PubChem CID	16971
CAS	2398-37-0
Molecular Weight (g/mol)	187.04
MDL Number	MFCD00000081
SMILES	COC1=CC=CC(Br)=C1
Synonym	3-bromoanisole,m-bromoanisole,3-methoxybromobenzene,3-bromo anisole,m-bromomethoxybenzene,benzene, 1-bromo-3-methoxy,anisole, m-bromo,3-methoxy-1-bromobenzene,m-methoxybromobenzene,meta-bromoanisole
IUPAC Name	1-bromo-3-methoxybenzene
InChI Key	PLDWAJLZAAHOGG-UHFFFAOYSA-N
Molecular Formula	C7H7BrO

1,789

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3-Chloro-2-methylanisole, 97%

CAS: 3260-88-6 Molecular Formula: C8H9ClO Molecular Weight (g/mol): 156.61 MDL Number: MFCD00070772 InChI Key: LTVRGAWOEOKGJZ-UHFFFAOYSA-N Synonym: 3-chloro-2-methylanisole,2-methyl-3-chloroanisole,2-chloro-6-methoxytoluene,benzene, 1-chloro-3-methoxy-2-methyl,2-methoxy-6-chlorotoluene,1-chloro-3-methoxy-2-methyl-benzene,pubchem2664,acmc-1cq3o,ltvrgawoeokgjz-uhfffaoysa PubChem CID: 76749 IUPAC Name: 1-chloro-3-methoxy-2-methylbenzene SMILES: COC1=CC=CC(Cl)=C1C

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Specifications

PubChem CID	76749
CAS	3260-88-6
Molecular Weight (g/mol)	156.61
MDL Number	MFCD00070772
SMILES	COC1=CC=CC(Cl)=C1C
Synonym	3-chloro-2-methylanisole,2-methyl-3-chloroanisole,2-chloro-6-methoxytoluene,benzene, 1-chloro-3-methoxy-2-methyl,2-methoxy-6-chlorotoluene,1-chloro-3-methoxy-2-methyl-benzene,pubchem2664,acmc-1cq3o,ltvrgawoeokgjz-uhfffaoysa
IUPAC Name	1-chloro-3-methoxy-2-methylbenzene
InChI Key	LTVRGAWOEOKGJZ-UHFFFAOYSA-N
Molecular Formula	C8H9ClO

1,790

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2-Bromo-5-methoxybenzonitrile, 98%, Thermo Scientific Chemicals

CAS: 138642-47-4 Molecular Formula: C8H6BrNO Molecular Weight (g/mol): 212.046 MDL Number: MFCD01861260 InChI Key: ZQONVYONOASKIY-UHFFFAOYSA-N Synonym: benzonitrile,2-bromo-5-methoxy,2-bromo-5-methoxybenzenecarbonitrile,4-bromo-3-cyanoanisole,acmc-20ag98,2-bromo-5-methoxy benzonitrile,2-bromo-5-methoxybenzonitrile,2-bromanyl-5-methoxy-benzenecarbonitrile PubChem CID: 21784096 IUPAC Name: 2-bromo-5-methoxybenzonitrile SMILES: COC1=CC(=C(C=C1)Br)C#N

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Specifications

PubChem CID	21784096
CAS	138642-47-4
Molecular Weight (g/mol)	212.046
MDL Number	MFCD01861260
SMILES	COC1=CC(=C(C=C1)Br)C#N
Synonym	benzonitrile,2-bromo-5-methoxy,2-bromo-5-methoxybenzenecarbonitrile,4-bromo-3-cyanoanisole,acmc-20ag98,2-bromo-5-methoxy benzonitrile,2-bromo-5-methoxybenzonitrile,2-bromanyl-5-methoxy-benzenecarbonitrile
IUPAC Name	2-bromo-5-methoxybenzonitrile
InChI Key	ZQONVYONOASKIY-UHFFFAOYSA-N
Molecular Formula	C8H6BrNO

1,791

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2-Bromo-5-chloroanisole, 98+%

CAS: 174913-09-8 Molecular Formula: C7H6BrClO Molecular Weight (g/mol): 221.478 MDL Number: MFCD03790889 InChI Key: CQGYLDZGJLVLMK-UHFFFAOYSA-N Synonym: 2-bromo-5-chloroanisole,benzene, 1-bromo-4-chloro-2-methoxy,pubchem5265,acmc-1c20c,ksc497i0p,2-bromo-5-chloroanisole, 98+%,2-methoxy-4-chloro-1-bromobenzene,1-bromo-4-chloro-2-methoxy-benzene PubChem CID: 17984845 IUPAC Name: 1-bromo-4-chloro-2-methoxybenzene SMILES: COC1=C(C=CC(=C1)Cl)Br

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Specifications

PubChem CID	17984845
CAS	174913-09-8
Molecular Weight (g/mol)	221.478
MDL Number	MFCD03790889
SMILES	COC1=C(C=CC(=C1)Cl)Br
Synonym	2-bromo-5-chloroanisole,benzene, 1-bromo-4-chloro-2-methoxy,pubchem5265,acmc-1c20c,ksc497i0p,2-bromo-5-chloroanisole, 98+%,2-methoxy-4-chloro-1-bromobenzene,1-bromo-4-chloro-2-methoxy-benzene
IUPAC Name	1-bromo-4-chloro-2-methoxybenzene
InChI Key	CQGYLDZGJLVLMK-UHFFFAOYSA-N
Molecular Formula	C7H6BrClO

1,792

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4-Ethylanisole, 98+%

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

1,793

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2,4,6-Trimethoxybenzonitrile, 98%

CAS: 2571-54-2 Molecular Formula: C10H11NO3 Molecular Weight (g/mol): 193.202 MDL Number: MFCD00001787 InChI Key: GBRHJUMDNWLSCT-UHFFFAOYSA-N PubChem CID: 75731 IUPAC Name: 2,4,6-trimethoxybenzonitrile SMILES: COC1=CC(=C(C(=C1)OC)C#N)OC

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PubChem CID	75731
CAS	2571-54-2
Molecular Weight (g/mol)	193.202
MDL Number	MFCD00001787
SMILES	COC1=CC(=C(C(=C1)OC)C#N)OC
IUPAC Name	2,4,6-trimethoxybenzonitrile
InChI Key	GBRHJUMDNWLSCT-UHFFFAOYSA-N
Molecular Formula	C10H11NO3

1,794

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2,4-Dibromoanisole, 98%, Thermo Scientific™

CAS: 21702-84-1 Molecular Formula: C₇H₆Br₂O Molecular Weight (g/mol): 265.92 MDL Number: MFCD00000079 InChI Key: XGXUGXPKRBQINS-UHFFFAOYSA-N Synonym: 2,4-dibromoanisole,benzene, 2,4-dibromo-1-methoxy,benzene,2,4-dibromo-1-methoxy,pubchem3847,acmc-209fnf,maybridge1_003667,chemwish ic06728,2,4-dibromo-1-methoxy-benzene,xgxugxpkrbqins-uhfffaoysa,# PubChem CID: 27011 IUPAC Name: 2,4-dibromo-1-methoxybenzene SMILES: COC1=C(C=C(C=C1)Br)Br

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PubChem CID	27011
CAS	21702-84-1
Molecular Weight (g/mol)	265.92
MDL Number	MFCD00000079
SMILES	COC1=C(C=C(C=C1)Br)Br
Synonym	2,4-dibromoanisole,benzene, 2,4-dibromo-1-methoxy,benzene,2,4-dibromo-1-methoxy,pubchem3847,acmc-209fnf,maybridge1_003667,chemwish ic06728,2,4-dibromo-1-methoxy-benzene,xgxugxpkrbqins-uhfffaoysa,#
IUPAC Name	2,4-dibromo-1-methoxybenzene
InChI Key	XGXUGXPKRBQINS-UHFFFAOYSA-N
Molecular Formula	C₇H₆Br₂O

1,795

2-Methylanisole, 99%

CAS: 578-58-5 Molecular Formula: C₈H₁₀O Molecular Weight (g/mol): 122.17 MDL Number: MFCD00008373 InChI Key: DTFKRVXLBCAIOZ-UHFFFAOYSA-N Synonym: 2-methylanisole,o-methylanisole,2-methoxytoluene,o-cresol methyl ether,o-cresyl methyl ether,anisole, o-methyl,benzene, 1-methoxy-2-methyl,methyl o-tolyl ether,o-methoxytoluene,2-methylmethoxybenzene PubChem CID: 33637 IUPAC Name: 1-methoxy-2-methylbenzene SMILES: CC1=CC=CC=C1OC

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Specifications

PubChem CID	33637
CAS	578-58-5
Molecular Weight (g/mol)	122.17
MDL Number	MFCD00008373
SMILES	CC1=CC=CC=C1OC
Synonym	2-methylanisole,o-methylanisole,2-methoxytoluene,o-cresol methyl ether,o-cresyl methyl ether,anisole, o-methyl,benzene, 1-methoxy-2-methyl,methyl o-tolyl ether,o-methoxytoluene,2-methylmethoxybenzene
IUPAC Name	1-methoxy-2-methylbenzene
InChI Key	DTFKRVXLBCAIOZ-UHFFFAOYSA-N
Molecular Formula	C₈H₁₀O

1,796

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2,4-Dichloroanisole, 99%

CAS: 553-82-2 Molecular Formula: C7H6Cl2O Molecular Weight (g/mol): 177.02 MDL Number: MFCD00044772 InChI Key: CICQUFBZCADHHX-UHFFFAOYSA-N Synonym: 2,4-dichloroanisole,benzene, 2,4-dichloro-1-methoxy,1,5-dichloro-2-methoxybenzene,2,4-dichloro-1-methoxy-benzene,anisole, 2,4-dichloro,2,4-dichloromethoxybenzene,anisole,4-dichloro,acmc-209lmo,ksc273i7j PubChem CID: 11119 IUPAC Name: 2,4-dichloro-1-methoxybenzene SMILES: COC1=CC=C(Cl)C=C1Cl

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Specifications

PubChem CID	11119
CAS	553-82-2
Molecular Weight (g/mol)	177.02
MDL Number	MFCD00044772
SMILES	COC1=CC=C(Cl)C=C1Cl
Synonym	2,4-dichloroanisole,benzene, 2,4-dichloro-1-methoxy,1,5-dichloro-2-methoxybenzene,2,4-dichloro-1-methoxy-benzene,anisole, 2,4-dichloro,2,4-dichloromethoxybenzene,anisole,4-dichloro,acmc-209lmo,ksc273i7j
IUPAC Name	2,4-dichloro-1-methoxybenzene
InChI Key	CICQUFBZCADHHX-UHFFFAOYSA-N
Molecular Formula	C7H6Cl2O

1,797

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Ethyl 3-methoxyphenylacetate, 98%

CAS: 35553-92-5 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00026897 InChI Key: XXVVNHCWPHMLEZ-UHFFFAOYSA-N Synonym: ethyl 3-methoxyphenylacetate,ethyl 2-3-methoxyphenyl acetate,ethyl 3-methoxyphenyl acetate,benzeneacetic acid, 3-methoxy-, ethyl ester,acmc-20akzh,3-methoxy-phenyl-acetic acid ethyl ester,ethyl 2-3-methoxyphenyl ethanoate,3-methoxyphenylacetic acid ethyl ester,3-methoxybenzeneacetic acid ethyl ester,2-3-methoxyphenyl acetic acid ethyl ester PubChem CID: 2774971 IUPAC Name: ethyl 2-(3-methoxyphenyl)acetate SMILES: CCOC(=O)CC1=CC(=CC=C1)OC

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PubChem CID	2774971
CAS	35553-92-5
Molecular Weight (g/mol)	194.23
MDL Number	MFCD00026897
SMILES	CCOC(=O)CC1=CC(=CC=C1)OC
Synonym	ethyl 3-methoxyphenylacetate,ethyl 2-3-methoxyphenyl acetate,ethyl 3-methoxyphenyl acetate,benzeneacetic acid, 3-methoxy-, ethyl ester,acmc-20akzh,3-methoxy-phenyl-acetic acid ethyl ester,ethyl 2-3-methoxyphenyl ethanoate,3-methoxyphenylacetic acid ethyl ester,3-methoxybenzeneacetic acid ethyl ester,2-3-methoxyphenyl acetic acid ethyl ester
IUPAC Name	ethyl 2-(3-methoxyphenyl)acetate
InChI Key	XXVVNHCWPHMLEZ-UHFFFAOYSA-N
Molecular Formula	C11H14O3

1,798

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2,2'-Dimethoxybiphenyl, 97%

CAS: 4877-93-4 Molecular Formula: C14H14O2 Molecular Weight (g/mol): 214.26 MDL Number: MFCD00067073 InChI Key: VGMKUVCDINAAFC-UHFFFAOYSA-N PubChem CID: 611816 IUPAC Name: 1-methoxy-2-(2-methoxyphenyl)benzene SMILES: COC1=CC=CC=C1C1=CC=CC=C1OC

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Specifications

PubChem CID	611816
CAS	4877-93-4
Molecular Weight (g/mol)	214.26
MDL Number	MFCD00067073
SMILES	COC1=CC=CC=C1C1=CC=CC=C1OC
IUPAC Name	1-methoxy-2-(2-methoxyphenyl)benzene
InChI Key	VGMKUVCDINAAFC-UHFFFAOYSA-N
Molecular Formula	C14H14O2

1,799

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2-Bromoanisole, 98%

CAS: 578-57-4 Molecular Formula: C7H7BrO Molecular Weight (g/mol): 187.036 MDL Number: MFCD00000064 InChI Key: HTDQSWDEWGSAMN-UHFFFAOYSA-N Synonym: 2-bromoanisole,o-bromoanisole,benzene, 1-bromo-2-methoxy,2-methoxybromobenzene,o-anisyl bromide,anisole, o-bromo,o-methoxybromobenzene,2-bromoanisol,o-methoxyphenyl bromide,2-methoxyphenyl bromide PubChem CID: 11358 IUPAC Name: 1-bromo-2-methoxybenzene SMILES: COC1=CC=CC=C1Br

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Specifications

PubChem CID	11358
CAS	578-57-4
Molecular Weight (g/mol)	187.036
MDL Number	MFCD00000064
SMILES	COC1=CC=CC=C1Br
Synonym	2-bromoanisole,o-bromoanisole,benzene, 1-bromo-2-methoxy,2-methoxybromobenzene,o-anisyl bromide,anisole, o-bromo,o-methoxybromobenzene,2-bromoanisol,o-methoxyphenyl bromide,2-methoxyphenyl bromide
IUPAC Name	1-bromo-2-methoxybenzene
InChI Key	HTDQSWDEWGSAMN-UHFFFAOYSA-N
Molecular Formula	C7H7BrO

1,800

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Eugenol, USP, Spectrum™ Chemical

CAS: 97-53-0 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.20 MDL Number: MFCD00008654 InChI Key: RRAFCDWBNXTKKO-UHFFFAOYSA-N IUPAC Name: 2-methoxy-4-(prop-2-en-1-yl)phenol SMILES: COC1=CC(CC=C)=CC=C1O

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Specifications

CAS	97-53-0
Molecular Weight (g/mol)	164.20
MDL Number	MFCD00008654
SMILES	COC1=CC(CC=C)=CC=C1O
IUPAC Name	2-methoxy-4-(prop-2-en-1-yl)phenol
InChI Key	RRAFCDWBNXTKKO-UHFFFAOYSA-N
Molecular Formula	C10H12O2

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