Benzenoids

Organic compounds that are derived from or have a benzene group in their molecular structure. Benzene is an aromatic organic molecule composed of 6 carbon atoms and 6 hydrogen atoms that form a ring. Includes derivatives and substituted molecules.

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886 – 900 of 78,418 results

886

5-Carbamoyl-2-fluorobenzeneboronic acid pinacol ester, 96%, Thermo Scientific™

CAS: 1412905-42-0 Molecular Formula: C13H17BFNO3 Molecular Weight (g/mol): 265.09 MDL Number: MFCD18730404 InChI Key: RBEAFMIZDXOHAT-UHFFFAOYSA-N Synonym: 4-fluoro-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzamide,5-carbamoyl-2-fluorobenzeneboronic acid pinacol ester PubChem CID: 99738340 IUPAC Name: 4-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide SMILES: CC1(C)OB(OC1(C)C)C1=C(F)C=CC(=C1)C(N)=O

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Specifications

PubChem CID	99738340
CAS	1412905-42-0
Molecular Weight (g/mol)	265.09
MDL Number	MFCD18730404
SMILES	CC1(C)OB(OC1(C)C)C1=C(F)C=CC(=C1)C(N)=O
Synonym	4-fluoro-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzamide,5-carbamoyl-2-fluorobenzeneboronic acid pinacol ester
IUPAC Name	4-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide
InChI Key	RBEAFMIZDXOHAT-UHFFFAOYSA-N
Molecular Formula	C13H17BFNO3

887

2-Bromobenzoic acid, 97%

CAS: 88-65-3 Molecular Formula: C₇H₅BrO₂ Molecular Weight (g/mol): 201.02 MDL Number: MFCD00002402 InChI Key: XRXMNWGCKISMOH-UHFFFAOYSA-N Synonym: o-bromobenzoic acid,benzoic acid, 2-bromo,bromobenzoic acid,benzoic acid, o-bromo,2-bromo-benzoic acid,benzoic acid, bromo,unii-az789tzs4l,az789tzs4l,ortho-bromobenzoic acid,attercop-chm at111657 PubChem CID: 6940 IUPAC Name: 2-bromobenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)Br

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Specifications

PubChem CID	6940
CAS	88-65-3
Molecular Weight (g/mol)	201.02
MDL Number	MFCD00002402
SMILES	C1=CC=C(C(=C1)C(=O)O)Br
Synonym	o-bromobenzoic acid,benzoic acid, 2-bromo,bromobenzoic acid,benzoic acid, o-bromo,2-bromo-benzoic acid,benzoic acid, bromo,unii-az789tzs4l,az789tzs4l,ortho-bromobenzoic acid,attercop-chm at111657
IUPAC Name	2-bromobenzoic acid
InChI Key	XRXMNWGCKISMOH-UHFFFAOYSA-N
Molecular Formula	C₇H₅BrO₂

888

Methyl 3-(4-bromophenyl)propionate, 97%

CAS: 75567-84-9 Molecular Formula: C10H11BrO2 Molecular Weight (g/mol): 243.1 MDL Number: MFCD09953150 InChI Key: FKPYNBFWCSTPOT-UHFFFAOYSA-N Synonym: methyl 3-4-bromophenyl propanoate,methyl 3-4-bromophenyl propionate,3-4-bromophenyl propanoic acid methyl ester,benzenepropanoic acid, 4-bromo-, methyl ester,3-4-bromophenyl propionic acid methyl ester,acmc-209oyw,3-4-bromophenyl propionate,ksc498a6l,methyl3-4-bromophenyl propionate,3-4-bromophenyl-propionic acid methyl ester PubChem CID: 11447883 IUPAC Name: methyl 3-(4-bromophenyl)propanoate SMILES: COC(=O)CCC1=CC=C(C=C1)Br

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Specifications

PubChem CID	11447883
CAS	75567-84-9
Molecular Weight (g/mol)	243.1
MDL Number	MFCD09953150
SMILES	COC(=O)CCC1=CC=C(C=C1)Br
Synonym	methyl 3-4-bromophenyl propanoate,methyl 3-4-bromophenyl propionate,3-4-bromophenyl propanoic acid methyl ester,benzenepropanoic acid, 4-bromo-, methyl ester,3-4-bromophenyl propionic acid methyl ester,acmc-209oyw,3-4-bromophenyl propionate,ksc498a6l,methyl3-4-bromophenyl propionate,3-4-bromophenyl-propionic acid methyl ester
IUPAC Name	methyl 3-(4-bromophenyl)propanoate
InChI Key	FKPYNBFWCSTPOT-UHFFFAOYSA-N
Molecular Formula	C10H11BrO2

889

(R)-(+)-1-(2-Bromophenyl)ethanol, 98%

CAS: 76116-20-6 Molecular Formula: C8H9BrO Molecular Weight (g/mol): 201.063 MDL Number: MFCD00216591 InChI Key: DZLZSFZSPIUINR-ZCFIWIBFSA-N Synonym: r-1-2-bromophenyl ethanol,1r-1-2-bromophenyl ethanol,1r-1-2-bromophenyl ethan-1-ol,pubchem5686,r-+-1-2-bromophenyl ethanol,r-+-2-bromo-,a-methylbenzyl alcohol,benzenemethanol,2-bromo-a-methyl-, ar,r-+-2-bromo-alpha-methylbenzyl alcohol,r-+-2-bromo-alpha-methylbenzyl alcoh PubChem CID: 2734868 IUPAC Name: (1R)-1-(2-bromophenyl)ethanol SMILES: CC(C1=CC=CC=C1Br)O

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Specifications

PubChem CID	2734868
CAS	76116-20-6
Molecular Weight (g/mol)	201.063
MDL Number	MFCD00216591
SMILES	CC(C1=CC=CC=C1Br)O
Synonym	r-1-2-bromophenyl ethanol,1r-1-2-bromophenyl ethanol,1r-1-2-bromophenyl ethan-1-ol,pubchem5686,r-+-1-2-bromophenyl ethanol,r-+-2-bromo-,a-methylbenzyl alcohol,benzenemethanol,2-bromo-a-methyl-, ar,r-+-2-bromo-alpha-methylbenzyl alcohol,r-+-2-bromo-alpha-methylbenzyl alcoh
IUPAC Name	(1R)-1-(2-bromophenyl)ethanol
InChI Key	DZLZSFZSPIUINR-ZCFIWIBFSA-N
Molecular Formula	C8H9BrO

890

1,2,4,5-Tetrabromobenzene, 97%

CAS: 636-28-2 Molecular Formula: C6H2Br4 Molecular Weight (g/mol): 393.70 MDL Number: MFCD00000063 InChI Key: QCKHVNQHBOGZER-UHFFFAOYSA-N PubChem CID: 12486 IUPAC Name: 1,2,4,5-tetrabromobenzene SMILES: BrC1=CC(Br)=C(Br)C=C1Br

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Specifications

PubChem CID	12486
CAS	636-28-2
Molecular Weight (g/mol)	393.70
MDL Number	MFCD00000063
SMILES	BrC1=CC(Br)=C(Br)C=C1Br
IUPAC Name	1,2,4,5-tetrabromobenzene
InChI Key	QCKHVNQHBOGZER-UHFFFAOYSA-N
Molecular Formula	C6H2Br4

891

2-Bromophenylacetic acid, 98+%

CAS: 18698-97-0 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.046 MDL Number: MFCD00004314 InChI Key: DWXSYDKEWORWBT-UHFFFAOYSA-N Synonym: 2-bromophenylacetic acid,2-2-bromophenyl acetic acid,o-bromophenylacetic acid,2-bromophenyl acetic acid,benzeneacetic acid, 2-bromo,2-bromophenylaceticacid,2-bromo-phenyl-acetic acid,pubchem7214,acmc-1btqg PubChem CID: 87754 IUPAC Name: 2-(2-bromophenyl)acetic acid SMILES: C1=CC=C(C(=C1)CC(=O)O)Br

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Specifications

PubChem CID	87754
CAS	18698-97-0
Molecular Weight (g/mol)	215.046
MDL Number	MFCD00004314
SMILES	C1=CC=C(C(=C1)CC(=O)O)Br
Synonym	2-bromophenylacetic acid,2-2-bromophenyl acetic acid,o-bromophenylacetic acid,2-bromophenyl acetic acid,benzeneacetic acid, 2-bromo,2-bromophenylaceticacid,2-bromo-phenyl-acetic acid,pubchem7214,acmc-1btqg
IUPAC Name	2-(2-bromophenyl)acetic acid
InChI Key	DWXSYDKEWORWBT-UHFFFAOYSA-N
Molecular Formula	C8H7BrO2

892

2-Bromo-1,4-dichlorobenzene, 98%

CAS: 1435-50-3 Molecular Formula: C6H3BrCl2 Molecular Weight (g/mol): 225.894 MDL Number: MFCD00018505 InChI Key: OVXVQBCRONSPDC-UHFFFAOYSA-N Synonym: 1-bromo-2,5-dichlorobenzene,benzene, 2-bromo-1,4-dichloro,2,5-dichlorobromobenzene,2-bromo-1,4-dichloro-benzene,benzene, brominated chlorinated,brominated chlorinated benzene,benzene, brominated and chlorinated,pubchem3609,acmc-1bze4,intermediates-zcf02095 PubChem CID: 15033 IUPAC Name: 2-bromo-1,4-dichlorobenzene SMILES: C1=CC(=C(C=C1Cl)Br)Cl

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Specifications

PubChem CID	15033
CAS	1435-50-3
Molecular Weight (g/mol)	225.894
MDL Number	MFCD00018505
SMILES	C1=CC(=C(C=C1Cl)Br)Cl
Synonym	1-bromo-2,5-dichlorobenzene,benzene, 2-bromo-1,4-dichloro,2,5-dichlorobromobenzene,2-bromo-1,4-dichloro-benzene,benzene, brominated chlorinated,brominated chlorinated benzene,benzene, brominated and chlorinated,pubchem3609,acmc-1bze4,intermediates-zcf02095
IUPAC Name	2-bromo-1,4-dichlorobenzene
InChI Key	OVXVQBCRONSPDC-UHFFFAOYSA-N
Molecular Formula	C6H3BrCl2

893

1,4-Dibromo-2,5-dimethoxybenzene, 98+%

CAS: 2674-34-2 Molecular Formula: C8H8Br2O2 Molecular Weight (g/mol): 295.958 MDL Number: MFCD00025694 InChI Key: CHCLRVOURKGRSW-UHFFFAOYSA-N Synonym: 2,5-dibromo-1,4-dimethoxybenzene,1,4-dibromo-2,5-dimethoxy-benzene,2,5-dibromohydroquinone dimethyl ether,benzene, 1,4-dibromo-2,5-dimethoxy,pubchem16840,acmc-209gsv,maybridge1_005131,ksc496i0h,2,5-dibromo-4-methoxyanisole,1,4-dibromo-3,6-dimethoxybenzene PubChem CID: 231240 IUPAC Name: 1,4-dibromo-2,5-dimethoxybenzene SMILES: COC1=CC(=C(C=C1Br)OC)Br

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Specifications

PubChem CID	231240
CAS	2674-34-2
Molecular Weight (g/mol)	295.958
MDL Number	MFCD00025694
SMILES	COC1=CC(=C(C=C1Br)OC)Br
Synonym	2,5-dibromo-1,4-dimethoxybenzene,1,4-dibromo-2,5-dimethoxy-benzene,2,5-dibromohydroquinone dimethyl ether,benzene, 1,4-dibromo-2,5-dimethoxy,pubchem16840,acmc-209gsv,maybridge1_005131,ksc496i0h,2,5-dibromo-4-methoxyanisole,1,4-dibromo-3,6-dimethoxybenzene
IUPAC Name	1,4-dibromo-2,5-dimethoxybenzene
InChI Key	CHCLRVOURKGRSW-UHFFFAOYSA-N
Molecular Formula	C8H8Br2O2

894

5-(4-bromophenyl)-3-methyl-1,2,4-oxadiazole, 97%, Thermo Scientific™

CAS: 71566-07-9 Molecular Formula: C9H7BrN2O Molecular Weight (g/mol): 239.072 InChI Key: AVXXUFMZRHQRTK-UHFFFAOYSA-N PubChem CID: 1214889 IUPAC Name: 5-(4-bromophenyl)-3-methyl-1,2,4-oxadiazole SMILES: CC1=NOC(=N1)C2=CC=C(C=C2)Br

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Specifications

PubChem CID	1214889
CAS	71566-07-9
Molecular Weight (g/mol)	239.072
SMILES	CC1=NOC(=N1)C2=CC=C(C=C2)Br
IUPAC Name	5-(4-bromophenyl)-3-methyl-1,2,4-oxadiazole
InChI Key	AVXXUFMZRHQRTK-UHFFFAOYSA-N
Molecular Formula	C9H7BrN2O

895

1-Bromo-3,5-dinitrobenzene, 98%

CAS: 18242-39-2 Molecular Formula: C6H3BrN2O4 Molecular Weight (g/mol): 247.004 MDL Number: MFCD00156596 InChI Key: OLDMYNWXIGPOCI-UHFFFAOYSA-N PubChem CID: 44534 IUPAC Name: 1-bromo-3,5-dinitrobenzene SMILES: C1=C(C=C(C=C1[N+](=O)[O-])Br)[N+](=O)[O-]

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Specifications

PubChem CID	44534
CAS	18242-39-2
Molecular Weight (g/mol)	247.004
MDL Number	MFCD00156596
SMILES	C1=C(C=C(C=C1[N+](=O)[O-])Br)[N+](=O)[O-]
IUPAC Name	1-bromo-3,5-dinitrobenzene
InChI Key	OLDMYNWXIGPOCI-UHFFFAOYSA-N
Molecular Formula	C6H3BrN2O4

896

2-Bromo-1,3-dichlorobenzene, 97%

CAS: 19393-92-1 Molecular Formula: C6H3BrCl2 Molecular Weight (g/mol): 225.894 MDL Number: MFCD00000574 InChI Key: UWOIDOQAQPUVOH-UHFFFAOYSA-N Synonym: 1-bromo-2,6-dichlorobenzene,2,6-dichlorobromobenzene,1,3-dichloro-2-bromobenzene,benzene, 2-bromo-1,3-dichloro,2,6-dichloro-1-bromobenzene,benzene, 1-bromo-2,6-dichloro,pubchem3610,acmc-209exg,2,6-dichlorobromo benzene,2,6-dichlorophenyl bromide PubChem CID: 29568 IUPAC Name: 2-bromo-1,3-dichlorobenzene SMILES: C1=CC(=C(C(=C1)Cl)Br)Cl

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Specifications

PubChem CID	29568
CAS	19393-92-1
Molecular Weight (g/mol)	225.894
MDL Number	MFCD00000574
SMILES	C1=CC(=C(C(=C1)Cl)Br)Cl
Synonym	1-bromo-2,6-dichlorobenzene,2,6-dichlorobromobenzene,1,3-dichloro-2-bromobenzene,benzene, 2-bromo-1,3-dichloro,2,6-dichloro-1-bromobenzene,benzene, 1-bromo-2,6-dichloro,pubchem3610,acmc-209exg,2,6-dichlorobromo benzene,2,6-dichlorophenyl bromide
IUPAC Name	2-bromo-1,3-dichlorobenzene
InChI Key	UWOIDOQAQPUVOH-UHFFFAOYSA-N
Molecular Formula	C6H3BrCl2

897

3-Benzyloxybromobenzene, 96%

CAS: 53087-13-1 Molecular Formula: C₁₃H₁₁BrO Molecular Weight (g/mol): 263.13 InChI Key: HVWZMGZBJCJDOX-UHFFFAOYSA-N Synonym: 1-benzyloxy-3-bromobenzene,3-benzyloxybromobenzene,benzyl 3-bromophenyl ether,1-bromo-3-benzyloxybenzene,3-benzyloxy bromobenzene,3-bromophenyl benzyl ether,benzene, 1-bromo-3-phenylmethoxy,1-benzyloxy-3-bromo-benzene,pubchem3065 PubChem CID: 2756638 IUPAC Name: 1-bromo-3-phenylmethoxybenzene SMILES: C1=CC=C(C=C1)COC2=CC(=CC=C2)Br

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Specifications

PubChem CID	2756638
CAS	53087-13-1
Molecular Weight (g/mol)	263.13
SMILES	C1=CC=C(C=C1)COC2=CC(=CC=C2)Br
Synonym	1-benzyloxy-3-bromobenzene,3-benzyloxybromobenzene,benzyl 3-bromophenyl ether,1-bromo-3-benzyloxybenzene,3-benzyloxy bromobenzene,3-bromophenyl benzyl ether,benzene, 1-bromo-3-phenylmethoxy,1-benzyloxy-3-bromo-benzene,pubchem3065
IUPAC Name	1-bromo-3-phenylmethoxybenzene
InChI Key	HVWZMGZBJCJDOX-UHFFFAOYSA-N
Molecular Formula	C₁₃H₁₁BrO

898

2,2'-Dibromobiphenyl, 98%

CAS: 13029-09-9 Molecular Formula: C₁₂H₈Br₂ Molecular Weight (g/mol): 312.01 MDL Number: MFCD00093707 InChI Key: DRKHIWKXLZCAKP-UHFFFAOYSA-N Synonym: 2,2'-dibromobiphenyl,2,2'-dibromo-1,1'-biphenyl,o,o'-dibromobiphenyl,1-bromo-2-2-bromophenyl benzene,1,1'-biphenyl, 2,2'-dibromo,unii-gsl06p6p2l,biphenyl, 2,2'-dibromo,gsl06p6p2l,1,1'-biphenyl, 2,2'-dibromo-9ci,biphenyl,2'-dibromo PubChem CID: 83060 IUPAC Name: 1-bromo-2-(2-bromophenyl)benzene SMILES: C1=CC=C(C(=C1)C2=CC=CC=C2Br)Br

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Specifications

PubChem CID	83060
CAS	13029-09-9
Molecular Weight (g/mol)	312.01
MDL Number	MFCD00093707
SMILES	C1=CC=C(C(=C1)C2=CC=CC=C2Br)Br
Synonym	2,2'-dibromobiphenyl,2,2'-dibromo-1,1'-biphenyl,o,o'-dibromobiphenyl,1-bromo-2-2-bromophenyl benzene,1,1'-biphenyl, 2,2'-dibromo,unii-gsl06p6p2l,biphenyl, 2,2'-dibromo,gsl06p6p2l,1,1'-biphenyl, 2,2'-dibromo-9ci,biphenyl,2'-dibromo
IUPAC Name	1-bromo-2-(2-bromophenyl)benzene
InChI Key	DRKHIWKXLZCAKP-UHFFFAOYSA-N
Molecular Formula	C₁₂H₈Br₂

899

Ethyl 4-bromophenylacetate, 98%

CAS: 14062-25-0 Molecular Formula: C10H11BrO2 Molecular Weight (g/mol): 243.1 MDL Number: MFCD00016333 InChI Key: ZFDCWHPNBWPPHG-UHFFFAOYSA-N Synonym: ethyl 4-bromophenylacetate,ethyl 2-4-bromophenyl acetate,4-bromophenylacetic acid ethyl ester,benzeneacetic acid, 4-bromo-, ethyl ester,4-bromo-phenyl-acetic acid ethyl ester,ethyl 4-bromophenyl acetate,4-bromo-benzeneacetic acid ethyl ester,ethyl-4-bromophenylacetate,pubchem20039,acmc-209ckw PubChem CID: 7020609 IUPAC Name: ethyl 2-(4-bromophenyl)acetate SMILES: CCOC(=O)CC1=CC=C(C=C1)Br

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Specifications

PubChem CID	7020609
CAS	14062-25-0
Molecular Weight (g/mol)	243.1
MDL Number	MFCD00016333
SMILES	CCOC(=O)CC1=CC=C(C=C1)Br
Synonym	ethyl 4-bromophenylacetate,ethyl 2-4-bromophenyl acetate,4-bromophenylacetic acid ethyl ester,benzeneacetic acid, 4-bromo-, ethyl ester,4-bromo-phenyl-acetic acid ethyl ester,ethyl 4-bromophenyl acetate,4-bromo-benzeneacetic acid ethyl ester,ethyl-4-bromophenylacetate,pubchem20039,acmc-209ckw
IUPAC Name	ethyl 2-(4-bromophenyl)acetate
InChI Key	ZFDCWHPNBWPPHG-UHFFFAOYSA-N
Molecular Formula	C10H11BrO2

900

1-Bromo-2-ethylbenzene, 98%

CAS: 1973-22-4 Molecular Formula: C8H9Br Molecular Weight (g/mol): 185.064 MDL Number: MFCD00000077 InChI Key: HVRUGFJYCAFAAN-UHFFFAOYSA-N PubChem CID: 16089 IUPAC Name: 1-bromo-2-ethylbenzene SMILES: CCC1=CC=CC=C1Br

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Specifications

PubChem CID	16089
CAS	1973-22-4
Molecular Weight (g/mol)	185.064
MDL Number	MFCD00000077
SMILES	CCC1=CC=CC=C1Br
IUPAC Name	1-bromo-2-ethylbenzene
InChI Key	HVRUGFJYCAFAAN-UHFFFAOYSA-N
Molecular Formula	C8H9Br

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