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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4,906 – 4,920 of 57,266 results

4,906

4,4'-Diaminodiphenylmethane 98.0+%, TCI America™

CAS: 101-77-9 Molecular Formula: C13H14N2 Molecular Weight (g/mol): 198.27 MDL Number: MFCD00007914 InChI Key: YBRVSVVVWCFQMG-UHFFFAOYSA-N Synonym: 4,4'-methylenedianiline,4,4'-diaminodiphenylmethane,dadpm,methylenedianiline,dianilinomethane,tonox,p,p'-methylenedianiline,dianilinemethane,bis 4-aminophenyl methane,4-4-aminobenzyl aniline PubChem CID: 7577 ChEBI: CHEBI:32506 IUPAC Name: 4-[(4-aminophenyl)methyl]aniline SMILES: NC1=CC=C(CC2=CC=C(N)C=C2)C=C1

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Specifications

PubChem CID	7577
CAS	101-77-9
Molecular Weight (g/mol)	198.27
ChEBI	CHEBI:32506
MDL Number	MFCD00007914
SMILES	NC1=CC=C(CC2=CC=C(N)C=C2)C=C1
Synonym	4,4'-methylenedianiline,4,4'-diaminodiphenylmethane,dadpm,methylenedianiline,dianilinomethane,tonox,p,p'-methylenedianiline,dianilinemethane,bis 4-aminophenyl methane,4-4-aminobenzyl aniline
IUPAC Name	4-[(4-aminophenyl)methyl]aniline
InChI Key	YBRVSVVVWCFQMG-UHFFFAOYSA-N
Molecular Formula	C13H14N2

4,907

Diphenylmethane 99.0+%, TCI America™

CAS: 101-81-5 Molecular Formula: C13H12 Molecular Weight (g/mol): 168.24 MDL Number: MFCD00004781 InChI Key: CZZYITDELCSZES-UHFFFAOYSA-N Synonym: diphenylmethane,ditan,ditane,benzene, 1,1'-methylenebis,diphenyl methane,benzene, benzyl,methane, diphenyl,1,1'-dimethylenebis benzene,benzene, phenylmethyl,methylenedibenzene PubChem CID: 7580 ChEBI: CHEBI:38884 IUPAC Name: benzylbenzene SMILES: C(C1=CC=CC=C1)C1=CC=CC=C1

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Specifications

PubChem CID	7580
CAS	101-81-5
Molecular Weight (g/mol)	168.24
ChEBI	CHEBI:38884
MDL Number	MFCD00004781
SMILES	C(C1=CC=CC=C1)C1=CC=CC=C1
Synonym	diphenylmethane,ditan,ditane,benzene, 1,1'-methylenebis,diphenyl methane,benzene, benzyl,methane, diphenyl,1,1'-dimethylenebis benzene,benzene, phenylmethyl,methylenedibenzene
IUPAC Name	benzylbenzene
InChI Key	CZZYITDELCSZES-UHFFFAOYSA-N
Molecular Formula	C13H12

4,908

3-Bromoanisole 98.0+%, TCI America™

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

4,909

p-Anisaldehyde (contains Acetic Acid, H2SO4) Ethanol Solution [for TLC Stain], TCI America™

CAS: 123-11-5 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00003385 InChI Key: ZRSNZINYAWTAHE-UHFFFAOYSA-N Synonym: p-anisaldehyde,anisaldehyde,anisic aldehyde,p-methoxybenzaldehyde,4-anisaldehyde,aubepine,p-anisic aldehyde,p-formylanisole,benzaldehyde, 4-methoxy,crategine PubChem CID: 31244 ChEBI: CHEBI:28235 IUPAC Name: 4-methoxybenzaldehyde SMILES: COC1=CC=C(C=C1)C=O

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Specifications

PubChem CID	31244
CAS	123-11-5
Molecular Weight (g/mol)	136.15
ChEBI	CHEBI:28235
MDL Number	MFCD00003385
SMILES	COC1=CC=C(C=C1)C=O
Synonym	p-anisaldehyde,anisaldehyde,anisic aldehyde,p-methoxybenzaldehyde,4-anisaldehyde,aubepine,p-anisic aldehyde,p-formylanisole,benzaldehyde, 4-methoxy,crategine
IUPAC Name	4-methoxybenzaldehyde
InChI Key	ZRSNZINYAWTAHE-UHFFFAOYSA-N
Molecular Formula	C8H8O2

4,910

Ethylene Glycol Diphenyl Ether 99.0+%, TCI America™

CAS: 104-66-5 Molecular Formula: C14H14O2 Molecular Weight (g/mol): 214.26 MDL Number: MFCD00003039 InChI Key: XCSGHNKDXGYELG-UHFFFAOYSA-N Synonym: 1,2-diphenoxyethane,ethylene glycol diphenyl ether,diphenyl glycol,ethane, 1,2-diphenoxy,benzene, 1,1'-1,2-ethanediylbis oxy bis,2-phenoxyethyl phenyl ether,unii-v9w31hx4aw,diphenyl cellosolve,1,1'-ethane-1,2-diylbis oxy dibenzene,2-phenoxyethoxy benzene PubChem CID: 7713 IUPAC Name: (2-phenoxyethoxy)benzene SMILES: C(COC1=CC=CC=C1)OC1=CC=CC=C1

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Specifications

PubChem CID	7713
CAS	104-66-5
Molecular Weight (g/mol)	214.26
MDL Number	MFCD00003039
SMILES	C(COC1=CC=CC=C1)OC1=CC=CC=C1
Synonym	1,2-diphenoxyethane,ethylene glycol diphenyl ether,diphenyl glycol,ethane, 1,2-diphenoxy,benzene, 1,1'-1,2-ethanediylbis oxy bis,2-phenoxyethyl phenyl ether,unii-v9w31hx4aw,diphenyl cellosolve,1,1'-ethane-1,2-diylbis oxy dibenzene,2-phenoxyethoxy benzene
IUPAC Name	(2-phenoxyethoxy)benzene
InChI Key	XCSGHNKDXGYELG-UHFFFAOYSA-N
Molecular Formula	C14H14O2

4,911

4-(Methylsulfonyl)benzoic Acid 98.0+%, TCI America™

CAS: 4052-30-6 Molecular Formula: C8H8O4S Molecular Weight (g/mol): 200.208 MDL Number: MFCD00007564 InChI Key: AJBWNNKDUMXZLM-UHFFFAOYSA-N Synonym: 4-methylsulfonyl benzoic acid,p-methylsulfonylbenzoic acid,4-methanesulfonyl-benzoic acid,4-methylsulphonylbenzoic acid,4-methylsulphonyl benzoic acid,4-methanesulfonylbenzoic acid,benzoic acid, 4-methylsulfonyl,p-methylsulphonyl benzoic acid,4-methanesulfonyl benzoic acid PubChem CID: 77670 IUPAC Name: 4-methylsulfonylbenzoic acid SMILES: CS(=O)(=O)C1=CC=C(C=C1)C(=O)O

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Specifications

PubChem CID	77670
CAS	4052-30-6
Molecular Weight (g/mol)	200.208
MDL Number	MFCD00007564
SMILES	CS(=O)(=O)C1=CC=C(C=C1)C(=O)O
Synonym	4-methylsulfonyl benzoic acid,p-methylsulfonylbenzoic acid,4-methanesulfonyl-benzoic acid,4-methylsulphonylbenzoic acid,4-methylsulphonyl benzoic acid,4-methanesulfonylbenzoic acid,benzoic acid, 4-methylsulfonyl,p-methylsulphonyl benzoic acid,4-methanesulfonyl benzoic acid
IUPAC Name	4-methylsulfonylbenzoic acid
InChI Key	AJBWNNKDUMXZLM-UHFFFAOYSA-N
Molecular Formula	C8H8O4S

4,912

Methyl 4-Hydroxybenzoate 99.0+%, TCI America™

CAS: 99-76-3 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00002352 InChI Key: LXCFILQKKLGQFO-UHFFFAOYSA-N Synonym: methylparaben,methyl paraben,methyl p-hydroxybenzoate,nipagin,methyl parahydroxybenzoate,maseptol,p-hydroxybenzoic acid methyl ester,4-hydroxybenzoic acid methyl ester,p-carbomethoxyphenol,tegosept m PubChem CID: 7456 ChEBI: CHEBI:31835 IUPAC Name: methyl 4-hydroxybenzoate SMILES: COC(=O)C1=CC=C(C=C1)O

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Specifications

PubChem CID	7456
CAS	99-76-3
Molecular Weight (g/mol)	152.149
ChEBI	CHEBI:31835
MDL Number	MFCD00002352
SMILES	COC(=O)C1=CC=C(C=C1)O
Synonym	methylparaben,methyl paraben,methyl p-hydroxybenzoate,nipagin,methyl parahydroxybenzoate,maseptol,p-hydroxybenzoic acid methyl ester,4-hydroxybenzoic acid methyl ester,p-carbomethoxyphenol,tegosept m
IUPAC Name	methyl 4-hydroxybenzoate
InChI Key	LXCFILQKKLGQFO-UHFFFAOYSA-N
Molecular Formula	C8H8O3

4,913

Isobutyl Salicylate 99.0+%, TCI America™

CAS: 87-19-4 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00020035 InChI Key: PTXDBYSCVQQBNF-UHFFFAOYSA-N Synonym: 2-Hydroxybenzoic Acid Isobutyl Ester, Salicylic Acid Isobutyl Ester PubChem CID: 6873 IUPAC Name: 2-methylpropyl 2-hydroxybenzoate SMILES: CC(C)COC(=O)C1=CC=CC=C1O

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Specifications

PubChem CID	6873
CAS	87-19-4
Molecular Weight (g/mol)	194.23
MDL Number	MFCD00020035
SMILES	CC(C)COC(=O)C1=CC=CC=C1O
Synonym	2-Hydroxybenzoic Acid Isobutyl Ester, Salicylic Acid Isobutyl Ester
IUPAC Name	2-methylpropyl 2-hydroxybenzoate
InChI Key	PTXDBYSCVQQBNF-UHFFFAOYSA-N
Molecular Formula	C11H14O3

4,914

Neostigmine Bromide 99.0+%, TCI America™

CAS: 114-80-7 Molecular Formula: C12H19BrN2O2 Molecular Weight (g/mol): 303.20 MDL Number: MFCD00011795 InChI Key: LULNWZDBKTWDGK-UHFFFAOYSA-M Synonym: neostigmine bromide,neo-proserin,eustigmin bromide,neoserine bromide,proserine bromide,stigmanol bromide,synstigmin bromide,leostigmine bromide,kirkstigmine bromide,philostigmin bromide PubChem CID: 8246 ChEBI: CHEBI:179557 IUPAC Name: 3-[(dimethylcarbamoyl)oxy]-N,N,N-trimethylanilinium bromide SMILES: [Br-].CN(C)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C

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Specifications

PubChem CID	8246
CAS	114-80-7
Molecular Weight (g/mol)	303.20
ChEBI	CHEBI:179557
MDL Number	MFCD00011795
SMILES	[Br-].CN(C)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C
Synonym	neostigmine bromide,neo-proserin,eustigmin bromide,neoserine bromide,proserine bromide,stigmanol bromide,synstigmin bromide,leostigmine bromide,kirkstigmine bromide,philostigmin bromide
IUPAC Name	3-[(dimethylcarbamoyl)oxy]-N,N,N-trimethylanilinium bromide
InChI Key	LULNWZDBKTWDGK-UHFFFAOYSA-M
Molecular Formula	C12H19BrN2O2

4,915

N-(tert-Butoxycarbonyl)-p-toluenesulfonamide 98.0+%, TCI America™

CAS: 18303-04-3 Molecular Formula: C12H17NO4S Molecular Weight (g/mol): 271.331 MDL Number: MFCD00134267 InChI Key: DUTLOVSBVBGNDM-UHFFFAOYSA-N Synonym: N-Boc-p-toluenesulfonamide PubChem CID: 688170 IUPAC Name: tert-butyl N-(4-methylphenyl)sulfonylcarbamate SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC(=O)OC(C)(C)C

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Specifications

PubChem CID	688170
CAS	18303-04-3
Molecular Weight (g/mol)	271.331
MDL Number	MFCD00134267
SMILES	CC1=CC=C(C=C1)S(=O)(=O)NC(=O)OC(C)(C)C
Synonym	N-Boc-p-toluenesulfonamide
IUPAC Name	tert-butyl N-(4-methylphenyl)sulfonylcarbamate
InChI Key	DUTLOVSBVBGNDM-UHFFFAOYSA-N
Molecular Formula	C12H17NO4S

4,916

5-Acetamido-N,N'-bis(2,3-dihydroxypropyl)-2,4,6-triiodoisophthalamide 97.0+%, TCI America™

CAS: 31127-80-7 Molecular Formula: C16H20I3N3O7 Molecular Weight (g/mol): 747.06 MDL Number: MFCD08063354 InChI Key: BHCBLTRDEYPMFZ-UHFFFAOYNA-N Synonym: 5-Acetamido-N,N′C-bis(2,3-dihydroxypropyl)-2,4,6-triiodo-1,3-benzenedicarboxamide PubChem CID: 11115326 IUPAC Name: N1,N3-bis(2,3-dihydroxypropyl)-5-acetamido-2,4,6-triiodobenzene-1,3-dicarboxamide SMILES: CC(=O)NC1=C(I)C(C(=O)NCC(O)CO)=C(I)C(C(=O)NCC(O)CO)=C1I

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Specifications

PubChem CID	11115326
CAS	31127-80-7
Molecular Weight (g/mol)	747.06
MDL Number	MFCD08063354
SMILES	CC(=O)NC1=C(I)C(C(=O)NCC(O)CO)=C(I)C(C(=O)NCC(O)CO)=C1I
Synonym	5-Acetamido-N,N′C-bis(2,3-dihydroxypropyl)-2,4,6-triiodo-1,3-benzenedicarboxamide
IUPAC Name	N1,N3-bis(2,3-dihydroxypropyl)-5-acetamido-2,4,6-triiodobenzene-1,3-dicarboxamide
InChI Key	BHCBLTRDEYPMFZ-UHFFFAOYNA-N
Molecular Formula	C16H20I3N3O7

4,917

Sodium p-Toluenesulfonate 90.0+%, TCI America™

CAS: 657-84-1 Molecular Formula: C7H7NaO3S Molecular Weight (g/mol): 194.18 MDL Number: MFCD00798566,MFCD00064388 InChI Key: KVCGISUBCHHTDD-UHFFFAOYSA-M Synonym: sodium p-toluenesulfonate,sodium 4-methylbenzenesulfonate,sodium tosylate,p-toluenesulfonic acid sodium salt,sodium toluenesulfonate,sodium toluenesulphonate,tosylate, sodium,naxonate hydrotrope,cyclophil sts 70,eltesol st 34 PubChem CID: 3720192 IUPAC Name: sodium 4-methylbenzene-1-sulfonate SMILES: [Na+].CC1=CC=C(C=C1)S([O-])(=O)=O

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Specifications

PubChem CID	3720192
CAS	657-84-1
Molecular Weight (g/mol)	194.18
MDL Number	MFCD00798566,MFCD00064388
SMILES	[Na+].CC1=CC=C(C=C1)S([O-])(=O)=O
Synonym	sodium p-toluenesulfonate,sodium 4-methylbenzenesulfonate,sodium tosylate,p-toluenesulfonic acid sodium salt,sodium toluenesulfonate,sodium toluenesulphonate,tosylate, sodium,naxonate hydrotrope,cyclophil sts 70,eltesol st 34
IUPAC Name	sodium 4-methylbenzene-1-sulfonate
InChI Key	KVCGISUBCHHTDD-UHFFFAOYSA-M
Molecular Formula	C7H7NaO3S

4,918

4-Diethylaminobenzoic Acid 98.0+%, TCI America™

CAS: 5429-28-7 Molecular Formula: C11H15NO2 Molecular Weight (g/mol): 193.246 MDL Number: MFCD00002538 InChI Key: LNYTUARMNSFFBE-UHFFFAOYSA-N Synonym: 4-diethylamino benzoic acid,benzoic acid, 4-diethylamino,4-n,n-diethylaminobenzoic acid,p-diethylamino benzoic acid,4-diethylaminobenzoicacid,acmc-209lfa,4-diethylamino benzoic,p-diethylaminobenzoic acid,4-diethylamino benzoicacid PubChem CID: 79480 IUPAC Name: 4-(diethylamino)benzoic acid SMILES: CCN(CC)C1=CC=C(C=C1)C(=O)O

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Specifications

PubChem CID	79480
CAS	5429-28-7
Molecular Weight (g/mol)	193.246
MDL Number	MFCD00002538
SMILES	CCN(CC)C1=CC=C(C=C1)C(=O)O
Synonym	4-diethylamino benzoic acid,benzoic acid, 4-diethylamino,4-n,n-diethylaminobenzoic acid,p-diethylamino benzoic acid,4-diethylaminobenzoicacid,acmc-209lfa,4-diethylamino benzoic,p-diethylaminobenzoic acid,4-diethylamino benzoicacid
IUPAC Name	4-(diethylamino)benzoic acid
InChI Key	LNYTUARMNSFFBE-UHFFFAOYSA-N
Molecular Formula	C11H15NO2

4,919

Mebendazole 98.0+%, TCI America™

CAS: 31431-39-7 Molecular Formula: C16H13N3O3 Molecular Weight (g/mol): 295.30 MDL Number: MFCD00057872 InChI Key: OPXLLQIJSORQAM-UHFFFAOYSA-N Synonym: mebendazole,vermox,telmin,mebenvet,pantelmin,vermirax,mebenoazole,ovitelmin,bantenol,mebutar PubChem CID: 4030 ChEBI: CHEBI:6704 IUPAC Name: methyl N-(6-benzoyl-1H-1,3-benzodiazol-2-yl)carbamate SMILES: COC(=O)NC1=NC2=CC=C(C=C2N1)C(=O)C1=CC=CC=C1

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Specifications

PubChem CID	4030
CAS	31431-39-7
Molecular Weight (g/mol)	295.30
ChEBI	CHEBI:6704
MDL Number	MFCD00057872
SMILES	COC(=O)NC1=NC2=CC=C(C=C2N1)C(=O)C1=CC=CC=C1
Synonym	mebendazole,vermox,telmin,mebenvet,pantelmin,vermirax,mebenoazole,ovitelmin,bantenol,mebutar
IUPAC Name	methyl N-(6-benzoyl-1H-1,3-benzodiazol-2-yl)carbamate
InChI Key	OPXLLQIJSORQAM-UHFFFAOYSA-N
Molecular Formula	C16H13N3O3

4,920

Dibenzyl Ether 95.0+%, TCI America™

CAS: 103-50-4 Molecular Formula: C14H14O Molecular Weight (g/mol): 198.265 MDL Number: MFCD00004780 InChI Key: MHDVGSVTJDSBDK-UHFFFAOYSA-N Synonym: dibenzyl ether,benzyl ether,benzyl oxide,dibenzylether,oxybis methylene dibenzene,plastikator ba,ba plasticizer,benzylether,ether, dibenzyl,plasticator ba PubChem CID: 7657 ChEBI: CHEBI:87411 IUPAC Name: phenylmethoxymethylbenzene SMILES: C1=CC=C(C=C1)COCC2=CC=CC=C2

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Specifications

PubChem CID	7657
CAS	103-50-4
Molecular Weight (g/mol)	198.265
ChEBI	CHEBI:87411
MDL Number	MFCD00004780
SMILES	C1=CC=C(C=C1)COCC2=CC=CC=C2
Synonym	dibenzyl ether,benzyl ether,benzyl oxide,dibenzylether,oxybis methylene dibenzene,plastikator ba,ba plasticizer,benzylether,ether, dibenzyl,plasticator ba
IUPAC Name	phenylmethoxymethylbenzene
InChI Key	MHDVGSVTJDSBDK-UHFFFAOYSA-N
Molecular Formula	C14H14O

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