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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5,071 – 5,085 of 57,283 results

5,071

Benzyltrimethylammonium Dichloroiodate 97.0+%, TCI America™

CAS: 114971-52-7 Molecular Formula: C10H16Cl2IN Molecular Weight (g/mol): 348.049 MDL Number: MFCD00075259 InChI Key: PPDJNZTUDFPAHX-UHFFFAOYSA-N Synonym: benzyltrimethylammonium dichloroiodate,benzyltrimethylammonium dichloroiodide,btma-icl2,benzyl trimethylammonium dichloroiodate,benzyltrimethylazanium; dichloroiodanuide,pubchem21920,benzyltrimethylammoniumdichloroiodate PubChem CID: 2724680 SMILES: C[N+](C)(C)CC1=CC=CC=C1.Cl[I-]Cl

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Specifications

PubChem CID	2724680
CAS	114971-52-7
Molecular Weight (g/mol)	348.049
MDL Number	MFCD00075259
SMILES	C[N+](C)(C)CC1=CC=CC=C1.Cl[I-]Cl
Synonym	benzyltrimethylammonium dichloroiodate,benzyltrimethylammonium dichloroiodide,btma-icl2,benzyl trimethylammonium dichloroiodate,benzyltrimethylazanium; dichloroiodanuide,pubchem21920,benzyltrimethylammoniumdichloroiodate
InChI Key	PPDJNZTUDFPAHX-UHFFFAOYSA-N
Molecular Formula	C10H16Cl2IN

5,072

2-(4-Diethylamino-2-hydroxybenzoyl)benzoic Acid 98.0+%, TCI America™

CAS: 5809-23-4 Molecular Formula: C18H19NO4 Molecular Weight (g/mol): 313.353 MDL Number: MFCD00134669 InChI Key: FQNKTJPBXAZUGC-UHFFFAOYSA-N PubChem CID: 79878 IUPAC Name: 2-[4-(diethylamino)-2-hydroxybenzoyl]benzoic acid SMILES: CCN(CC)C1=CC(=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O)O

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Specifications

PubChem CID	79878
CAS	5809-23-4
Molecular Weight (g/mol)	313.353
MDL Number	MFCD00134669
SMILES	CCN(CC)C1=CC(=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O)O
IUPAC Name	2-[4-(diethylamino)-2-hydroxybenzoyl]benzoic acid
InChI Key	FQNKTJPBXAZUGC-UHFFFAOYSA-N
Molecular Formula	C18H19NO4

5,073

2-Hydroxy-4-methylbenzophenone 97.0+%, TCI America™

CAS: 3098-18-8 Molecular Formula: C14H12O2 Molecular Weight (g/mol): 212.25 MDL Number: MFCD01099035 InChI Key: KIZCNUWGIVQQBK-UHFFFAOYSA-N PubChem CID: 137824 IUPAC Name: 2-benzoyl-5-methylphenol SMILES: CC1=CC=C(C(=O)C2=CC=CC=C2)C(O)=C1

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Specifications

PubChem CID	137824
CAS	3098-18-8
Molecular Weight (g/mol)	212.25
MDL Number	MFCD01099035
SMILES	CC1=CC=C(C(=O)C2=CC=CC=C2)C(O)=C1
IUPAC Name	2-benzoyl-5-methylphenol
InChI Key	KIZCNUWGIVQQBK-UHFFFAOYSA-N
Molecular Formula	C14H12O2

5,074

2,4-Dichlorobenzophenone 97.0+%, TCI America™

CAS: 19811-05-3 Molecular Formula: C13H8Cl2O Molecular Weight (g/mol): 251.11 MDL Number: MFCD00018374 InChI Key: VLTYTTRXESKBKI-UHFFFAOYSA-N PubChem CID: 72867 IUPAC Name: (2,4-dichlorophenyl)(phenyl)methanone SMILES: ClC1=CC=C(C(=O)C2=CC=CC=C2)C(Cl)=C1

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Specifications

PubChem CID	72867
CAS	19811-05-3
Molecular Weight (g/mol)	251.11
MDL Number	MFCD00018374
SMILES	ClC1=CC=C(C(=O)C2=CC=CC=C2)C(Cl)=C1
IUPAC Name	(2,4-dichlorophenyl)(phenyl)methanone
InChI Key	VLTYTTRXESKBKI-UHFFFAOYSA-N
Molecular Formula	C13H8Cl2O

5,075

1,3-Bis(4-chlorophenyl)thiourea 98.0+%, TCI America™

CAS: 1220-00-4 Molecular Formula: C13H10Cl2N2S Molecular Weight (g/mol): 297.20 MDL Number: MFCD00275761 InChI Key: SYJZYFOTCABQES-UHFFFAOYSA-N PubChem CID: 2798589 IUPAC Name: 1,3-bis(4-chlorophenyl)thiourea SMILES: ClC1=CC=C(NC(=S)NC2=CC=C(Cl)C=C2)C=C1

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Specifications

PubChem CID	2798589
CAS	1220-00-4
Molecular Weight (g/mol)	297.20
MDL Number	MFCD00275761
SMILES	ClC1=CC=C(NC(=S)NC2=CC=C(Cl)C=C2)C=C1
IUPAC Name	1,3-bis(4-chlorophenyl)thiourea
InChI Key	SYJZYFOTCABQES-UHFFFAOYSA-N
Molecular Formula	C13H10Cl2N2S

5,076

3-Phenoxybenzyl Alcohol, TCI America™

CAS: 13826-35-2 Molecular Formula: C13H12O2 Molecular Weight (g/mol): 200.237 MDL Number: MFCD00004636 InChI Key: KGANAERDZBAECK-UHFFFAOYSA-N Synonym: 3-phenoxybenzyl alcohol,3-phenoxyphenyl methanol,3-phenoxybenzylalcohol,m-phenoxybenzyl alcohol,3-phenoxybenzenemethanol,benzenemethanol, 3-phenoxy,3-hydroxymethyl diphenyl ether,3-phenoxybenzylic alcohol,benzyl alcohol, m-phenoxy,3-pboh PubChem CID: 26295 ChEBI: CHEBI:62527 IUPAC Name: (3-phenoxyphenyl)methanol SMILES: C1=CC=C(C=C1)OC2=CC=CC(=C2)CO

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Specifications

PubChem CID	26295
CAS	13826-35-2
Molecular Weight (g/mol)	200.237
ChEBI	CHEBI:62527
MDL Number	MFCD00004636
SMILES	C1=CC=C(C=C1)OC2=CC=CC(=C2)CO
Synonym	3-phenoxybenzyl alcohol,3-phenoxyphenyl methanol,3-phenoxybenzylalcohol,m-phenoxybenzyl alcohol,3-phenoxybenzenemethanol,benzenemethanol, 3-phenoxy,3-hydroxymethyl diphenyl ether,3-phenoxybenzylic alcohol,benzyl alcohol, m-phenoxy,3-pboh
IUPAC Name	(3-phenoxyphenyl)methanol
InChI Key	KGANAERDZBAECK-UHFFFAOYSA-N
Molecular Formula	C13H12O2

5,077

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

5,078

m-(2-Fluorophenoxy)toluene, TCI America™

CAS: 78850-78-9 Molecular Formula: C13H11FO Molecular Weight (g/mol): 202.228 MDL Number: MFCD01321169 InChI Key: LTTPKDJFHJHNPA-UHFFFAOYSA-N Synonym: 2-Fluoro-3′C-methyldiphenyl Ether, 2-Fluorophenyl m-Tolyl Ether PubChem CID: 20570698 IUPAC Name: 1-fluoro-2-(3-methylphenoxy)benzene SMILES: CC1=CC(=CC=C1)OC2=CC=CC=C2F

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Specifications

PubChem CID	20570698
CAS	78850-78-9
Molecular Weight (g/mol)	202.228
MDL Number	MFCD01321169
SMILES	CC1=CC(=CC=C1)OC2=CC=CC=C2F
Synonym	2-Fluoro-3′C-methyldiphenyl Ether, 2-Fluorophenyl m-Tolyl Ether
IUPAC Name	1-fluoro-2-(3-methylphenoxy)benzene
InChI Key	LTTPKDJFHJHNPA-UHFFFAOYSA-N
Molecular Formula	C13H11FO

5,079

4,4'-Oxybis(benzenesulfonyl Chloride) 97.0+%, TCI America™

CAS: 121-63-1 Molecular Formula: C12H8Cl2O5S2 Molecular Weight (g/mol): 367.21 MDL Number: MFCD00024884 InChI Key: HJKXLQIPODSWMB-UHFFFAOYSA-N Synonym: 4,4'-bis chlorosulfonyl diphenyl ether,bis 4-chlorosulfonylphenyl ether,4,4'-oxybis benzenesulfonyl chloride,4,4'-oxydibenzenesulfonyl chloride,oxybis benzenesulfonyl chloride,4,4'-oxybenzenesulfonylchloride,benzenesulfonyl chloride, 4,4'-oxybis,oxybis 4-benzenesulfonyl chloride,p,p'-oxybis benzenesulfonyl chloride,phenoxybenzene-4,4'-disulfonyl chloride PubChem CID: 8484 IUPAC Name: 4-[4-(chlorosulfonyl)phenoxy]benzene-1-sulfonyl chloride SMILES: ClS(=O)(=O)C1=CC=C(OC2=CC=C(C=C2)S(Cl)(=O)=O)C=C1

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Specifications

PubChem CID	8484
CAS	121-63-1
Molecular Weight (g/mol)	367.21
MDL Number	MFCD00024884
SMILES	ClS(=O)(=O)C1=CC=C(OC2=CC=C(C=C2)S(Cl)(=O)=O)C=C1
Synonym	4,4'-bis chlorosulfonyl diphenyl ether,bis 4-chlorosulfonylphenyl ether,4,4'-oxybis benzenesulfonyl chloride,4,4'-oxydibenzenesulfonyl chloride,oxybis benzenesulfonyl chloride,4,4'-oxybenzenesulfonylchloride,benzenesulfonyl chloride, 4,4'-oxybis,oxybis 4-benzenesulfonyl chloride,p,p'-oxybis benzenesulfonyl chloride,phenoxybenzene-4,4'-disulfonyl chloride
IUPAC Name	4-[4-(chlorosulfonyl)phenoxy]benzene-1-sulfonyl chloride
InChI Key	HJKXLQIPODSWMB-UHFFFAOYSA-N
Molecular Formula	C12H8Cl2O5S2

5,080

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

5,081

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

5,082

Phenyl Ether 99.0+%, TCI America™

CAS: 101-84-8 Molecular Formula: C12H10O Molecular Weight (g/mol): 170.211 MDL Number: MFCD00003034 InChI Key: USIUVYZYUHIAEV-UHFFFAOYSA-N Synonym: diphenyl ether,diphenyl oxide,phenyl ether,oxydibenzene,phenyl oxide,oxybisbenzene,biphenyl oxide,1,1'-oxydibenzene,benzene, 1,1'-oxybis,oxydiphenyl PubChem CID: 7583 ChEBI: CHEBI:39258 IUPAC Name: phenoxybenzene SMILES: C1=CC=C(C=C1)OC2=CC=CC=C2

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Specifications

PubChem CID	7583
CAS	101-84-8
Molecular Weight (g/mol)	170.211
ChEBI	CHEBI:39258
MDL Number	MFCD00003034
SMILES	C1=CC=C(C=C1)OC2=CC=CC=C2
Synonym	diphenyl ether,diphenyl oxide,phenyl ether,oxydibenzene,phenyl oxide,oxybisbenzene,biphenyl oxide,1,1'-oxydibenzene,benzene, 1,1'-oxybis,oxydiphenyl
IUPAC Name	phenoxybenzene
InChI Key	USIUVYZYUHIAEV-UHFFFAOYSA-N
Molecular Formula	C12H10O

5,083

3-(4-Methoxyphenoxy)benzaldehyde 97.0+%, TCI America™

CAS: 62373-80-2 Molecular Formula: C14H12O3 Molecular Weight (g/mol): 228.247 MDL Number: MFCD00003358 InChI Key: WLFDEVVCXPTAQA-UHFFFAOYSA-N Synonym: 3-4-methoxyphenoxy benzaldehyde,benzaldehyde, 3-4-methoxyphenoxy,acmc-209n2y,3-4-methoxyphenoxy-benzaldehyde,3-formyl-4'-methoxydiphenyl ether,3-4-methoxy phenoxy benzaldehyde PubChem CID: 123553 IUPAC Name: 3-(4-methoxyphenoxy)benzaldehyde SMILES: COC1=CC=C(C=C1)OC2=CC=CC(=C2)C=O

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Specifications

PubChem CID	123553
CAS	62373-80-2
Molecular Weight (g/mol)	228.247
MDL Number	MFCD00003358
SMILES	COC1=CC=C(C=C1)OC2=CC=CC(=C2)C=O
Synonym	3-4-methoxyphenoxy benzaldehyde,benzaldehyde, 3-4-methoxyphenoxy,acmc-209n2y,3-4-methoxyphenoxy-benzaldehyde,3-formyl-4'-methoxydiphenyl ether,3-4-methoxy phenoxy benzaldehyde
IUPAC Name	3-(4-methoxyphenoxy)benzaldehyde
InChI Key	WLFDEVVCXPTAQA-UHFFFAOYSA-N
Molecular Formula	C14H12O3

5,084

2,2'-Bis(hydroxymethyl)diphenyl Ether 98.0+%, TCI America™

CAS: 10038-40-1 Molecular Formula: C14H14O3 Molecular Weight (g/mol): 230.263 MDL Number: MFCD00191613 InChI Key: VRVKKKKXKVCPEW-UHFFFAOYSA-N PubChem CID: 611393 IUPAC Name: [2-[2-(hydroxymethyl)phenoxy]phenyl]methanol SMILES: C1=CC=C(C(=C1)CO)OC2=CC=CC=C2CO

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Specifications

PubChem CID	611393
CAS	10038-40-1
Molecular Weight (g/mol)	230.263
MDL Number	MFCD00191613
SMILES	C1=CC=C(C(=C1)CO)OC2=CC=CC=C2CO
IUPAC Name	[2-[2-(hydroxymethyl)phenoxy]phenyl]methanol
InChI Key	VRVKKKKXKVCPEW-UHFFFAOYSA-N
Molecular Formula	C14H14O3

5,085

2-Nitrophenol Sodium Salt 99.0+%, TCI America™

CAS: 824-39-5 Molecular Formula: C6H4NNaO3 Molecular Weight (g/mol): 161.092 MDL Number: MFCD00065178 InChI Key: AXKBOWBNOCUNJL-UHFFFAOYSA-M Synonym: Sodium 2-Nitrophenol PubChem CID: 69985 IUPAC Name: sodium;2-nitrophenolate SMILES: C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]

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Specifications

PubChem CID	69985
CAS	824-39-5
Molecular Weight (g/mol)	161.092
MDL Number	MFCD00065178
SMILES	C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]
Synonym	Sodium 2-Nitrophenol
IUPAC Name	sodium;2-nitrophenolate
InChI Key	AXKBOWBNOCUNJL-UHFFFAOYSA-M
Molecular Formula	C6H4NNaO3

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Benzene and substituted derivatives

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