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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6,541 – 6,555 of 76,516 results

6,541

3,5-Bis(4-nitrophenoxy)benzoic Acid 98.0+%, TCI America™

CAS: 173550-33-9 Molecular Formula: C19H12N2O8 Molecular Weight (g/mol): 396.31 MDL Number: MFCD02093450 InChI Key: JOSXKPZXMVHRKU-UHFFFAOYSA-N Synonym: 3,5-bis 4-nitrophenoxy benzoic acid,gamma-secretase modulator, cw,cw,acmc-1cuip,josxkpzxmvhrku-uhfffaoysa PubChem CID: 16760376 IUPAC Name: 3,5-bis(4-nitrophenoxy)benzoic acid SMILES: OC(=O)C1=CC(OC2=CC=C(C=C2)[N+]([O-])=O)=CC(OC2=CC=C(C=C2)[N+]([O-])=O)=C1

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Specifications

PubChem CID	16760376
CAS	173550-33-9
Molecular Weight (g/mol)	396.31
MDL Number	MFCD02093450
SMILES	OC(=O)C1=CC(OC2=CC=C(C=C2)[N+]([O-])=O)=CC(OC2=CC=C(C=C2)[N+]([O-])=O)=C1
Synonym	3,5-bis 4-nitrophenoxy benzoic acid,gamma-secretase modulator, cw,cw,acmc-1cuip,josxkpzxmvhrku-uhfffaoysa
IUPAC Name	3,5-bis(4-nitrophenoxy)benzoic acid
InChI Key	JOSXKPZXMVHRKU-UHFFFAOYSA-N
Molecular Formula	C19H12N2O8

6,542

Belleau's Reagent [Sulfurating Reagent], TCI America™

CAS: 88816-02-8 Molecular Formula: C24H18O2P2S4 Molecular Weight (g/mol): 528.594 MDL Number: MFCD00191383 InChI Key: BFIWQSSAMKDRRZ-UHFFFAOYSA-N Synonym: 2,4-Bis(4-phenoxyphenyl)-1,3-dithia-2,4-diphosphetane 2,4-Disulfide PubChem CID: 11813414 IUPAC Name: 2,4-bis(4-phenoxyphenyl)-2,4-bis(sulfanylidene)-1,3,2$l^{5},4$l^{5}-dithiadiphosphetane SMILES: C1=CC=C(C=C1)OC2=CC=C(C=C2)P3(=S)SP(=S)(S3)C4=CC=C(C=C4)OC5=CC=CC=C5

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Specifications

PubChem CID	11813414
CAS	88816-02-8
Molecular Weight (g/mol)	528.594
MDL Number	MFCD00191383
SMILES	C1=CC=C(C=C1)OC2=CC=C(C=C2)P3(=S)SP(=S)(S3)C4=CC=C(C=C4)OC5=CC=CC=C5
Synonym	2,4-Bis(4-phenoxyphenyl)-1,3-dithia-2,4-diphosphetane 2,4-Disulfide
IUPAC Name	2,4-bis(4-phenoxyphenyl)-2,4-bis(sulfanylidene)-1,3,2$l^{5},4$l^{5}-dithiadiphosphetane
InChI Key	BFIWQSSAMKDRRZ-UHFFFAOYSA-N
Molecular Formula	C24H18O2P2S4

6,543

2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl Bromide 98.0+%, TCI America™

CAS: 377780-72-8 Molecular Formula: C13H18BBrO2 Molecular Weight (g/mol): 296.999 MDL Number: MFCD01632210 InChI Key: ROIXSNLOYHDYBP-UHFFFAOYSA-N Synonym: 2-2-bromomethyl phenyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2-bromomethylphenylboronic acid pinacol ester,2-bromomethyl benzeneboronic acid, pinacol ester,2-bromomethylphenylboronic acid, pinacol ester,2-bromomethyl benzeneboronic acid pinacol ester,2-bromomethylphenyl boronic acid, pinacol ester,amtb373,2-bromomethyl phenylboronic pinacol ester,2-bromoethylphenylboronic acid pinacol ester PubChem CID: 3834834 IUPAC Name: 2-[2-(bromomethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC=CC=C2CBr

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Specifications

PubChem CID	3834834
CAS	377780-72-8
Molecular Weight (g/mol)	296.999
MDL Number	MFCD01632210
SMILES	B1(OC(C(O1)(C)C)(C)C)C2=CC=CC=C2CBr
Synonym	2-2-bromomethyl phenyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2-bromomethylphenylboronic acid pinacol ester,2-bromomethyl benzeneboronic acid, pinacol ester,2-bromomethylphenylboronic acid, pinacol ester,2-bromomethyl benzeneboronic acid pinacol ester,2-bromomethylphenyl boronic acid, pinacol ester,amtb373,2-bromomethyl phenylboronic pinacol ester,2-bromoethylphenylboronic acid pinacol ester
IUPAC Name	2-[2-(bromomethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI Key	ROIXSNLOYHDYBP-UHFFFAOYSA-N
Molecular Formula	C13H18BBrO2

6,544

2-Chloro-5-fluorobenzyl Bromide 96.0+%, TCI America™

CAS: 81778-09-8 Molecular Formula: C7H5BrClF Molecular Weight (g/mol): 223.469 MDL Number: MFCD01631419 InChI Key: AUVLFQDKJFSFIX-UHFFFAOYSA-N Synonym: 2-chloro-5-fluorobenzyl bromide,2-bromomethyl-1-chloro-4-fluorobenzene,2-chloro-5-fluorobenzylbromide,1-bromomethyl-2-chloro-5-fluorobenzene,pubchem7498,acmc-1blqd,2-bromomethyl-1-chloro-4-fluoro-benzene,2-chloro5-fluorobenzyl bromide,2-chloro-5-fluoro-benzylbromide,2-chloro-5-fluoro-benzyl bromide PubChem CID: 2773623 IUPAC Name: 2-(bromomethyl)-1-chloro-4-fluorobenzene SMILES: C1=CC(=C(C=C1F)CBr)Cl

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Specifications

PubChem CID	2773623
CAS	81778-09-8
Molecular Weight (g/mol)	223.469
MDL Number	MFCD01631419
SMILES	C1=CC(=C(C=C1F)CBr)Cl
Synonym	2-chloro-5-fluorobenzyl bromide,2-bromomethyl-1-chloro-4-fluorobenzene,2-chloro-5-fluorobenzylbromide,1-bromomethyl-2-chloro-5-fluorobenzene,pubchem7498,acmc-1blqd,2-bromomethyl-1-chloro-4-fluoro-benzene,2-chloro5-fluorobenzyl bromide,2-chloro-5-fluoro-benzylbromide,2-chloro-5-fluoro-benzyl bromide
IUPAC Name	2-(bromomethyl)-1-chloro-4-fluorobenzene
InChI Key	AUVLFQDKJFSFIX-UHFFFAOYSA-N
Molecular Formula	C7H5BrClF

6,545

m-Toluidine 98.0+%, TCI America™

CAS: 108-44-1 Molecular Formula: C7H9N Molecular Weight (g/mol): 107.16 MDL Number: MFCD00007808 InChI Key: JJYPMNFTHPTTDI-UHFFFAOYSA-N Synonym: m-toluidine,3-toluidine,benzenamine, 3-methyl,3-aminotoluene,m-methylaniline,m-tolylamine,m-toluidin,m-aminotoluene,m-methylbenzenamine,3-methylbenzenamine PubChem CID: 7934 IUPAC Name: 3-methylaniline SMILES: CC1=CC=CC(N)=C1

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Specifications

PubChem CID	7934
CAS	108-44-1
Molecular Weight (g/mol)	107.16
MDL Number	MFCD00007808
SMILES	CC1=CC=CC(N)=C1
Synonym	m-toluidine,3-toluidine,benzenamine, 3-methyl,3-aminotoluene,m-methylaniline,m-tolylamine,m-toluidin,m-aminotoluene,m-methylbenzenamine,3-methylbenzenamine
IUPAC Name	3-methylaniline
InChI Key	JJYPMNFTHPTTDI-UHFFFAOYSA-N
Molecular Formula	C7H9N

6,546

4-(4-Chlorophenoxy)benzonitrile 98.0+%, TCI America™

CAS: 74448-92-3 Molecular Formula: C13H8ClNO Molecular Weight (g/mol): 229.663 InChI Key: SOTAPBLDXLHNRZ-UHFFFAOYSA-N Synonym: 4-Chloro-4′C-cyanodiphenyl Ether PubChem CID: 11195570 IUPAC Name: 4-(4-chlorophenoxy)benzonitrile SMILES: C1=CC(=CC=C1C#N)OC2=CC=C(C=C2)Cl

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Specifications

PubChem CID	11195570
CAS	74448-92-3
Molecular Weight (g/mol)	229.663
SMILES	C1=CC(=CC=C1C#N)OC2=CC=C(C=C2)Cl
Synonym	4-Chloro-4′C-cyanodiphenyl Ether
IUPAC Name	4-(4-chlorophenoxy)benzonitrile
InChI Key	SOTAPBLDXLHNRZ-UHFFFAOYSA-N
Molecular Formula	C13H8ClNO

6,547

Nalpha-(5-Fluoro-2,4-dinitrophenyl)-L-alaninamide 95.0+%, TCI America™

CAS: 95713-52-3 Molecular Formula: C9H9FN4O5 Molecular Weight (g/mol): 272.19 MDL Number: MFCD00042049 InChI Key: NEPLBHLFDJOJGP-BYPYZUCNSA-N Synonym: marfey's reagent,s-2-5-fluoro-2,4-dinitrophenyl amino propanamide,2s-2-5-fluoro-2,4-dinitrophenyl amino propanamide,n-2,4-dinitro-5-fluorophenyl-l-alaninamide,2s-2-5-fluoro-2,4-dinitroanilino propanamide,propanamide, 2-5-fluoro-2,4-dinitrophenyl amino-, 2s,nalpha-2,4-dinitro-5-fluorophenyl-l-alaninamide,n-alpha-2,4-dinitro-5-fluorophenyl-l-alaninamide,fdaa,1-fd-aa PubChem CID: 5486955 IUPAC Name: (2S)-2-[(5-fluoro-2,4-dinitrophenyl)amino]propanamide SMILES: C[C@H](NC1=CC(F)=C(C=C1[N+]([O-])=O)[N+]([O-])=O)C(N)=O

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Specifications

PubChem CID	5486955
CAS	95713-52-3
Molecular Weight (g/mol)	272.19
MDL Number	MFCD00042049
SMILES	C[C@H](NC1=CC(F)=C(C=C1[N+]([O-])=O)[N+]([O-])=O)C(N)=O
Synonym	marfey's reagent,s-2-5-fluoro-2,4-dinitrophenyl amino propanamide,2s-2-5-fluoro-2,4-dinitrophenyl amino propanamide,n-2,4-dinitro-5-fluorophenyl-l-alaninamide,2s-2-5-fluoro-2,4-dinitroanilino propanamide,propanamide, 2-5-fluoro-2,4-dinitrophenyl amino-, 2s,nalpha-2,4-dinitro-5-fluorophenyl-l-alaninamide,n-alpha-2,4-dinitro-5-fluorophenyl-l-alaninamide,fdaa,1-fd-aa
IUPAC Name	(2S)-2-[(5-fluoro-2,4-dinitrophenyl)amino]propanamide
InChI Key	NEPLBHLFDJOJGP-BYPYZUCNSA-N
Molecular Formula	C9H9FN4O5

6,548

2,6-Dihydroxy-4-methylbenzoic Acid, TCI America™

CAS: 480-67-1 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.148 MDL Number: MFCD00184686 InChI Key: YBZAVRDNSPUMFK-UHFFFAOYSA-N Synonym: 2,6-Dihydroxy-p-toluic Acid PubChem CID: 68074 IUPAC Name: 2,6-dihydroxy-4-methylbenzoic acid SMILES: CC1=CC(=C(C(=C1)O)C(=O)O)O

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Specifications

PubChem CID	68074
CAS	480-67-1
Molecular Weight (g/mol)	168.148
MDL Number	MFCD00184686
SMILES	CC1=CC(=C(C(=C1)O)C(=O)O)O
Synonym	2,6-Dihydroxy-p-toluic Acid
IUPAC Name	2,6-dihydroxy-4-methylbenzoic acid
InChI Key	YBZAVRDNSPUMFK-UHFFFAOYSA-N
Molecular Formula	C8H8O4

6,549

4,4'-Dinitrodiphenyl Ether 99.0+%, TCI America™

CAS: 101-63-3 Molecular Formula: C12H8N2O5 Molecular Weight (g/mol): 260.205 MDL Number: MFCD00059182 InChI Key: MWAGUKZCDDRDCS-UHFFFAOYSA-N PubChem CID: 7568 IUPAC Name: 1-nitro-4-(4-nitrophenoxy)benzene SMILES: C1=CC(=CC=C1[N+](=O)[O-])OC2=CC=C(C=C2)[N+](=O)[O-]

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Specifications

PubChem CID	7568
CAS	101-63-3
Molecular Weight (g/mol)	260.205
MDL Number	MFCD00059182
SMILES	C1=CC(=CC=C1[N+](=O)[O-])OC2=CC=C(C=C2)[N+](=O)[O-]
IUPAC Name	1-nitro-4-(4-nitrophenoxy)benzene
InChI Key	MWAGUKZCDDRDCS-UHFFFAOYSA-N
Molecular Formula	C12H8N2O5

6,550

1,4-Bis(4-aminophenoxy)benzene 98.0+%, TCI America™

CAS: 3491-12-1 Molecular Formula: C18H16N2O2 Molecular Weight (g/mol): 292.34 MDL Number: MFCD00039153 InChI Key: JCRRFJIVUPSNTA-UHFFFAOYSA-N Synonym: Hydroquinone Bis(4-aminophenyl) Ether PubChem CID: 19012 IUPAC Name: 4-[4-(4-aminophenoxy)phenoxy]aniline SMILES: C1=CC(=CC=C1N)OC2=CC=C(C=C2)OC3=CC=C(C=C3)N

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Specifications

PubChem CID	19012
CAS	3491-12-1
Molecular Weight (g/mol)	292.34
MDL Number	MFCD00039153
SMILES	C1=CC(=CC=C1N)OC2=CC=C(C=C2)OC3=CC=C(C=C3)N
Synonym	Hydroquinone Bis(4-aminophenyl) Ether
IUPAC Name	4-[4-(4-aminophenoxy)phenoxy]aniline
InChI Key	JCRRFJIVUPSNTA-UHFFFAOYSA-N
Molecular Formula	C18H16N2O2

6,551

4-(4-Fluorophenoxy)benzonitrile 98.0+%, TCI America™

CAS: 215589-24-5 Molecular Formula: C13H8FNO Molecular Weight (g/mol): 213.211 InChI Key: NXVPHQNXBDDVCT-UHFFFAOYSA-N Synonym: 4-4-fluorophenoxy benzonitrile,4-4-fluorophenoxy benzenecarbonitrile,acmc-1chxs,4-cyano-4'-fluorodiphenyl ether,benzonitrile,4-4-fluorophenoxy PubChem CID: 1490284 IUPAC Name: 4-(4-fluorophenoxy)benzonitrile SMILES: C1=CC(=CC=C1C#N)OC2=CC=C(C=C2)F

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Specifications

PubChem CID	1490284
CAS	215589-24-5
Molecular Weight (g/mol)	213.211
SMILES	C1=CC(=CC=C1C#N)OC2=CC=C(C=C2)F
Synonym	4-4-fluorophenoxy benzonitrile,4-4-fluorophenoxy benzenecarbonitrile,acmc-1chxs,4-cyano-4'-fluorodiphenyl ether,benzonitrile,4-4-fluorophenoxy
IUPAC Name	4-(4-fluorophenoxy)benzonitrile
InChI Key	NXVPHQNXBDDVCT-UHFFFAOYSA-N
Molecular Formula	C13H8FNO

6,552

2,2'-Dithiobis(6-fluorobenzoic Acid) 98.0+%, TCI America™

CAS: 147027-64-3 Molecular Formula: C14H8F2O4S2 Molecular Weight (g/mol): 342.331 InChI Key: QEONSZINEMHFPH-UHFFFAOYSA-N Synonym: Bis(2-carboxy-3-fluorophenyl) Disulfide PubChem CID: 9974633 IUPAC Name: 2-[(2-carboxy-3-fluorophenyl)disulfanyl]-6-fluorobenzoic acid SMILES: C1=CC(=C(C(=C1)SSC2=CC=CC(=C2C(=O)O)F)C(=O)O)F

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Specifications

PubChem CID	9974633
CAS	147027-64-3
Molecular Weight (g/mol)	342.331
SMILES	C1=CC(=C(C(=C1)SSC2=CC=CC(=C2C(=O)O)F)C(=O)O)F
Synonym	Bis(2-carboxy-3-fluorophenyl) Disulfide
IUPAC Name	2-[(2-carboxy-3-fluorophenyl)disulfanyl]-6-fluorobenzoic acid
InChI Key	QEONSZINEMHFPH-UHFFFAOYSA-N
Molecular Formula	C14H8F2O4S2

6,553

3,5-Difluoroaniline 98.0+%, TCI America™

CAS: 372-39-4 Molecular Formula: C6H5F2N Molecular Weight (g/mol): 129.11 MDL Number: MFCD00007763 InChI Key: KQOIBXZRCYFZSO-UHFFFAOYSA-N Synonym: benzenamine, 3,5-difluoro,3,5-difluorobenzenamine,3,5-difluorophenylamine,5an,3,5-difluoranilin,3,5-difluoroanilin,3,5 difluoroaniline,3.5-difluoroaniline,pubchem2296,3, 5-difluoroaniline PubChem CID: 96595 IUPAC Name: 3,5-difluoroaniline SMILES: C1=C(C=C(C=C1F)F)N

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Specifications

PubChem CID	96595
CAS	372-39-4
Molecular Weight (g/mol)	129.11
MDL Number	MFCD00007763
SMILES	C1=C(C=C(C=C1F)F)N
Synonym	benzenamine, 3,5-difluoro,3,5-difluorobenzenamine,3,5-difluorophenylamine,5an,3,5-difluoranilin,3,5-difluoroanilin,3,5 difluoroaniline,3.5-difluoroaniline,pubchem2296,3, 5-difluoroaniline
IUPAC Name	3,5-difluoroaniline
InChI Key	KQOIBXZRCYFZSO-UHFFFAOYSA-N
Molecular Formula	C6H5F2N

6,554

4,5-Dibromo-1,2-phenylenediamine 98.0+%, TCI America™

CAS: 49764-63-8 Molecular Formula: C6H6Br2N2 Molecular Weight (g/mol): 265.94 MDL Number: MFCD00795598 InChI Key: TTXGKCVKGXHPRI-UHFFFAOYSA-N Synonym: 1,2-Diamino-4,5-dibromobenzene PubChem CID: 12196944 IUPAC Name: 4,5-dibromobenzene-1,2-diamine SMILES: NC1=CC(Br)=C(Br)C=C1N

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Specifications

PubChem CID	12196944
CAS	49764-63-8
Molecular Weight (g/mol)	265.94
MDL Number	MFCD00795598
SMILES	NC1=CC(Br)=C(Br)C=C1N
Synonym	1,2-Diamino-4,5-dibromobenzene
IUPAC Name	4,5-dibromobenzene-1,2-diamine
InChI Key	TTXGKCVKGXHPRI-UHFFFAOYSA-N
Molecular Formula	C6H6Br2N2

6,555

Diphenylacetaldehyde 95.0+%, TCI America™

CAS: 947-91-1 Molecular Formula: C14H12O Molecular Weight (g/mol): 196.25 MDL Number: MFCD00006972 InChI Key: HLLGFGBLKOIZOM-UHFFFAOYSA-N Synonym: diphenylacetaldehyde,diphenylketen,acetaldehyde, diphenyl,alpha-phenylbenzeneacetaldehyde,diphenylethanal,diphenyl-acetaldehyde,benzeneacetaldehyde, .alpha.-phenyl,diphenyl-acetaldehyd,benzeneacetaldehyde, ?-phenyl,diphenylacetoaldehyde PubChem CID: 13696 IUPAC Name: 2,2-diphenylacetaldehyde SMILES: O=CC(C1=CC=CC=C1)C1=CC=CC=C1

Pricing & Availability
Specifications

PubChem CID	13696
CAS	947-91-1
Molecular Weight (g/mol)	196.25
MDL Number	MFCD00006972
SMILES	O=CC(C1=CC=CC=C1)C1=CC=CC=C1
Synonym	diphenylacetaldehyde,diphenylketen,acetaldehyde, diphenyl,alpha-phenylbenzeneacetaldehyde,diphenylethanal,diphenyl-acetaldehyde,benzeneacetaldehyde, .alpha.-phenyl,diphenyl-acetaldehyd,benzeneacetaldehyde, ?-phenyl,diphenylacetoaldehyde
IUPAC Name	2,2-diphenylacetaldehyde
InChI Key	HLLGFGBLKOIZOM-UHFFFAOYSA-N
Molecular Formula	C14H12O

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