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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3,511 – 3,525 of 57,008 results

3,511

N1-[3-(Ethylamino)-4-methylphenyl]acetamide, 97%, Thermo Scientific™

CAS: 63134-04-3 Molecular Formula: C11H16N2O Molecular Weight (g/mol): 192.262 MDL Number: MFCD00157616 InChI Key: MRNDZGBBVKUGJY-UHFFFAOYSA-N Synonym: n-3-ethylamino-4-methylphenyl acetamide,n1-3-ethylamino-4-methylphenyl acetamide,acetamide, n-3-ethylamino-4-methylphenyl,maybridge1_002559 PubChem CID: 113042 IUPAC Name: N-[3-(ethylamino)-4-methylphenyl]acetamide SMILES: CCNC1=C(C=CC(=C1)NC(=O)C)C

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Specifications

PubChem CID	113042
CAS	63134-04-3
Molecular Weight (g/mol)	192.262
MDL Number	MFCD00157616
SMILES	CCNC1=C(C=CC(=C1)NC(=O)C)C
Synonym	n-3-ethylamino-4-methylphenyl acetamide,n1-3-ethylamino-4-methylphenyl acetamide,acetamide, n-3-ethylamino-4-methylphenyl,maybridge1_002559
IUPAC Name	N-[3-(ethylamino)-4-methylphenyl]acetamide
InChI Key	MRNDZGBBVKUGJY-UHFFFAOYSA-N
Molecular Formula	C11H16N2O

3,512

2-Bromo-4,6-difluoroaniline, 98%

CAS: 444-14-4 Molecular Formula: C6H4BrF2N Molecular Weight (g/mol): 208.01 MDL Number: MFCD00009639 InChI Key: WUJKFVGKLTWVSQ-UHFFFAOYSA-N Synonym: 2,4-difluoro-6-bromoaniline,6-bromo-2,4-difluoroaniline,2-bromo-4,6-difluoro-phenylamine,2-bromo-4,6-difluorobenzenamine,benzenamine, 2-bromo-4,6-difluoro,2-bromo-4,6-difluorophenylamine,pubchem2913,acmc-1ao2h,2-bromo4,6-difluoroaniline PubChem CID: 136285 IUPAC Name: 2-bromo-4,6-difluoroaniline SMILES: NC1=C(F)C=C(F)C=C1Br

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Specifications

PubChem CID	136285
CAS	444-14-4
Molecular Weight (g/mol)	208.01
MDL Number	MFCD00009639
SMILES	NC1=C(F)C=C(F)C=C1Br
Synonym	2,4-difluoro-6-bromoaniline,6-bromo-2,4-difluoroaniline,2-bromo-4,6-difluoro-phenylamine,2-bromo-4,6-difluorobenzenamine,benzenamine, 2-bromo-4,6-difluoro,2-bromo-4,6-difluorophenylamine,pubchem2913,acmc-1ao2h,2-bromo4,6-difluoroaniline
IUPAC Name	2-bromo-4,6-difluoroaniline
InChI Key	WUJKFVGKLTWVSQ-UHFFFAOYSA-N
Molecular Formula	C6H4BrF2N

3,513

2,6-Dibromotoluene, 98+%

CAS: 69321-60-4 Molecular Formula: C7H6Br2 Molecular Weight (g/mol): 249.93 MDL Number: MFCD00013524 InChI Key: OCSKCBIGEMSDIS-UHFFFAOYSA-N Synonym: 2,6-dibromotoluene,benzene, 1,3-dibromo-2-methyl,1,3-dibromo-2-methyl-benzene,pubchem3926,acmc-1bagq,ksc493g1t,#,2,6-dibromotoluene 1g PubChem CID: 34681 IUPAC Name: 1,3-dibromo-2-methylbenzene SMILES: CC1=C(Br)C=CC=C1Br

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Specifications

PubChem CID	34681
CAS	69321-60-4
Molecular Weight (g/mol)	249.93
MDL Number	MFCD00013524
SMILES	CC1=C(Br)C=CC=C1Br
Synonym	2,6-dibromotoluene,benzene, 1,3-dibromo-2-methyl,1,3-dibromo-2-methyl-benzene,pubchem3926,acmc-1bagq,ksc493g1t,#,2,6-dibromotoluene 1g
IUPAC Name	1,3-dibromo-2-methylbenzene
InChI Key	OCSKCBIGEMSDIS-UHFFFAOYSA-N
Molecular Formula	C7H6Br2

3,514

3-Methylbenzyl chloride, 98%

CAS: 620-19-9 Molecular Formula: C8H9Cl Molecular Weight (g/mol): 140.61 MDL Number: MFCD00000909 InChI Key: LZBOHNCMCCSTJX-UHFFFAOYSA-N Synonym: 3-methylbenzyl chloride,1-chloromethyl-3-methylbenzene,m-xylyl chloride,3-methylbenzylchloride,alpha-chloro-m-xylene,m-methylbenzyl chloride,1-chloromethyl-3-methyl-benzene,m-chloromethyl toluene,3-chloromethyl toluene,benzene, 1-chloromethyl-3-methyl PubChem CID: 12102 IUPAC Name: 1-(chloromethyl)-3-methylbenzene SMILES: CC1=CC(=CC=C1)CCl

Pricing & Availability
Specifications

PubChem CID	12102
CAS	620-19-9
Molecular Weight (g/mol)	140.61
MDL Number	MFCD00000909
SMILES	CC1=CC(=CC=C1)CCl
Synonym	3-methylbenzyl chloride,1-chloromethyl-3-methylbenzene,m-xylyl chloride,3-methylbenzylchloride,alpha-chloro-m-xylene,m-methylbenzyl chloride,1-chloromethyl-3-methyl-benzene,m-chloromethyl toluene,3-chloromethyl toluene,benzene, 1-chloromethyl-3-methyl
IUPAC Name	1-(chloromethyl)-3-methylbenzene
InChI Key	LZBOHNCMCCSTJX-UHFFFAOYSA-N
Molecular Formula	C8H9Cl

3,515

Allyltriphenylphosphonium chloride, 99%

CAS: 18480-23-4 Molecular Formula: C21H20ClP Molecular Weight (g/mol): 338.81 MDL Number: MFCD00031542 InChI Key: FKMJROWWQOJRJX-UHFFFAOYSA-M Synonym: allyltriphenylphosphonium chloride,allyl triphenylphosphonium chloride,triphenyl prop-2-enyl phosphanium chloride,triphenyl prop-2-en-1-yl phosphanium chloride,acmc-1buz2,allyltriphenylphosphoniumchloride,triphenyl prop-2-enyl phosphonium chloride,phosphonium,triphenyl-2-propen-1-yl-, chloride 1:1 PubChem CID: 2734120 SMILES: [Cl-].C=CC[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1

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Specifications

PubChem CID	2734120
CAS	18480-23-4
Molecular Weight (g/mol)	338.81
MDL Number	MFCD00031542
SMILES	[Cl-].C=CC[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
Synonym	allyltriphenylphosphonium chloride,allyl triphenylphosphonium chloride,triphenyl prop-2-enyl phosphanium chloride,triphenyl prop-2-en-1-yl phosphanium chloride,acmc-1buz2,allyltriphenylphosphoniumchloride,triphenyl prop-2-enyl phosphonium chloride,phosphonium,triphenyl-2-propen-1-yl-, chloride 1:1
InChI Key	FKMJROWWQOJRJX-UHFFFAOYSA-M
Molecular Formula	C21H20ClP

3,516

5-Bromo-2-fluorobenzonitrile, 98%

CAS: 179897-89-3 Molecular Formula: C7H3BrFN Molecular Weight (g/mol): 200.01 MDL Number: MFCD00143424 InChI Key: GYCNHFWRPJXTSB-UHFFFAOYSA-N Synonym: 2-fluoro-5-bromobenzonitrile,benzonitrile, 5-bromo-2-fluoro,5-bromo-2-fluorobenzenecarbonitrile,3-cyano-4-fluorobromobenzene,3-cyano-4-fluoro-bromobenzene,5-bromo-2-fluoro-benzonitrile,ablock ab-11-0918,pubchem1582,2-fluoro5-bromobenzonitrile,3-cyano-4-flurobromobenzene PubChem CID: 2724900 IUPAC Name: 5-bromo-2-fluorobenzonitrile SMILES: C1=CC(=C(C=C1Br)C#N)F

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Specifications

PubChem CID	2724900
CAS	179897-89-3
Molecular Weight (g/mol)	200.01
MDL Number	MFCD00143424
SMILES	C1=CC(=C(C=C1Br)C#N)F
Synonym	2-fluoro-5-bromobenzonitrile,benzonitrile, 5-bromo-2-fluoro,5-bromo-2-fluorobenzenecarbonitrile,3-cyano-4-fluorobromobenzene,3-cyano-4-fluoro-bromobenzene,5-bromo-2-fluoro-benzonitrile,ablock ab-11-0918,pubchem1582,2-fluoro5-bromobenzonitrile,3-cyano-4-flurobromobenzene
IUPAC Name	5-bromo-2-fluorobenzonitrile
InChI Key	GYCNHFWRPJXTSB-UHFFFAOYSA-N
Molecular Formula	C7H3BrFN

3,517

3-Iodobenzoic acid, 98+%

CAS: 618-51-9 Molecular Formula: C7H5IO2 Molecular Weight (g/mol): 248.019 MDL Number: MFCD00002496 InChI Key: KVBWBCRPWVKFQT-UHFFFAOYSA-N Synonym: m-iodobenzoic acid,benzoic acid, 3-iodo,3-iodo-benzoic acid,benzoic acid, m-iodo,3-iodobenzoicacid,3-carboxyiodobenzene,3-iodo benzoic acid,pubchem3925,acmc-209mwv,meta-carboxy iodo-benzene PubChem CID: 12060 IUPAC Name: 3-iodobenzoic acid SMILES: C1=CC(=CC(=C1)I)C(=O)O

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Specifications

PubChem CID	12060
CAS	618-51-9
Molecular Weight (g/mol)	248.019
MDL Number	MFCD00002496
SMILES	C1=CC(=CC(=C1)I)C(=O)O
Synonym	m-iodobenzoic acid,benzoic acid, 3-iodo,3-iodo-benzoic acid,benzoic acid, m-iodo,3-iodobenzoicacid,3-carboxyiodobenzene,3-iodo benzoic acid,pubchem3925,acmc-209mwv,meta-carboxy iodo-benzene
IUPAC Name	3-iodobenzoic acid
InChI Key	KVBWBCRPWVKFQT-UHFFFAOYSA-N
Molecular Formula	C7H5IO2

3,518

Ribonucleic acid, MP Biomedicals™

CAS: 63231-63-0 MDL Number: MFCD00132196 Synonym: RNA IUPAC Name: Ribonucleic acid

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Specifications

CAS	63231-63-0
MDL Number	MFCD00132196
Synonym	RNA
IUPAC Name	Ribonucleic acid

3,519

Methyl 3-bromo-4-hydroxybenzoate, 98%

CAS: 29415-97-2 Molecular Formula: C8H7BrO3 Molecular Weight (g/mol): 231.05 MDL Number: MFCD06203850 InChI Key: RKUNSPWAQIUGEZ-UHFFFAOYSA-N Synonym: methyl3-bromo-4-hydroxybenzoate,3-bromo-4-hydroxybenzoic acid methyl ester,benzoic acid, 3-bromo-4-hydroxy-, methyl ester,2-bromo-4-methoxycarbonyl phenol,methyl 4-hydroxy-3-bromobenzoate,methyl-3-bromo-4-hydroxybenzoate,methyl 3-bromo-4-hydroxy-benzoate,methyl 3-bromo-4-hydroxybenzoate,methyl 3-bromanyl-4-oxidanyl-benzoate,3-bromo-4-hydroxy-benzoic acid methyl ester PubChem CID: 4778958 IUPAC Name: methyl 3-bromo-4-hydroxybenzoate SMILES: COC(=O)C1=CC(Br)=C(O)C=C1

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Specifications

PubChem CID	4778958
CAS	29415-97-2
Molecular Weight (g/mol)	231.05
MDL Number	MFCD06203850
SMILES	COC(=O)C1=CC(Br)=C(O)C=C1
Synonym	methyl3-bromo-4-hydroxybenzoate,3-bromo-4-hydroxybenzoic acid methyl ester,benzoic acid, 3-bromo-4-hydroxy-, methyl ester,2-bromo-4-methoxycarbonyl phenol,methyl 4-hydroxy-3-bromobenzoate,methyl-3-bromo-4-hydroxybenzoate,methyl 3-bromo-4-hydroxy-benzoate,methyl 3-bromo-4-hydroxybenzoate,methyl 3-bromanyl-4-oxidanyl-benzoate,3-bromo-4-hydroxy-benzoic acid methyl ester
IUPAC Name	methyl 3-bromo-4-hydroxybenzoate
InChI Key	RKUNSPWAQIUGEZ-UHFFFAOYSA-N
Molecular Formula	C8H7BrO3

3,520

(-)-Dibenzoyl-L-tartaric acid monohydrate, 98%

CAS: 62708-56-9 Molecular Formula: C18H14O8 Molecular Weight (g/mol): 358.30 MDL Number: MFCD00149119 InChI Key: YONLFQNRGZXBBF-OKILXGFUSA-N Synonym: 2r,3r-2,3-bis benzoyloxy succinic acid hydrate,--dibenzoyl-l-tartaric acid monohydrate,--dibenzoyl-l-tartaric acidmonohydrate,dibenzoyl-l---tartaric acid monohydrate,l--dibenzoyl-l-tartatic acid monohydrate,2r,3r---dibenzoyl-l-tartaric acid monohydrate,2r,3r-2,3-bis benzoyloxy butanedioic acid hydrate,dibenzoyl-l-tartaric acid monohydrate,l-dbta,pubchem7152 PubChem CID: 44119738 SMILES: OC(=O)[C@@H](OC(=O)C1=CC=CC=C1)[C@@H](OC(=O)C1=CC=CC=C1)C(O)=O

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Specifications

PubChem CID	44119738
CAS	62708-56-9
Molecular Weight (g/mol)	358.30
MDL Number	MFCD00149119
SMILES	OC(=O)[C@@H](OC(=O)C1=CC=CC=C1)[C@@H](OC(=O)C1=CC=CC=C1)C(O)=O
Synonym	2r,3r-2,3-bis benzoyloxy succinic acid hydrate,--dibenzoyl-l-tartaric acid monohydrate,--dibenzoyl-l-tartaric acidmonohydrate,dibenzoyl-l---tartaric acid monohydrate,l--dibenzoyl-l-tartatic acid monohydrate,2r,3r---dibenzoyl-l-tartaric acid monohydrate,2r,3r-2,3-bis benzoyloxy butanedioic acid hydrate,dibenzoyl-l-tartaric acid monohydrate,l-dbta,pubchem7152
InChI Key	YONLFQNRGZXBBF-OKILXGFUSA-N
Molecular Formula	C18H14O8

3,521

2-Bromobenzylamine, 98%

CAS: 3959-05-5 Molecular Formula: C₇H₈BrN Molecular Weight (g/mol): 186.05 MDL Number: MFCD00025572 InChI Key: NOYASZMZIBFFNZ-UHFFFAOYSA-N Synonym: 2-bromobenzylamine,2-bromophenyl methanamine,o-bromobenzylamine,2-bromophenyl methylamine,1-2-bromophenyl methanamine,2-brobenzylamine,2-bromo-benzylamine,pubchem20398,acmc-1ct06,benzenemethanamine, 2-bromo PubChem CID: 334072 IUPAC Name: (2-bromophenyl)methanamine SMILES: C1=CC=C(C(=C1)CN)Br

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Specifications

PubChem CID	334072
CAS	3959-05-5
Molecular Weight (g/mol)	186.05
MDL Number	MFCD00025572
SMILES	C1=CC=C(C(=C1)CN)Br
Synonym	2-bromobenzylamine,2-bromophenyl methanamine,o-bromobenzylamine,2-bromophenyl methylamine,1-2-bromophenyl methanamine,2-brobenzylamine,2-bromo-benzylamine,pubchem20398,acmc-1ct06,benzenemethanamine, 2-bromo
IUPAC Name	(2-bromophenyl)methanamine
InChI Key	NOYASZMZIBFFNZ-UHFFFAOYSA-N
Molecular Formula	C₇H₈BrN

3,522

4-Cyanobenzoic acid, 99%

CAS: 619-65-8 Molecular Formula: C₈H₅NO₂ Molecular Weight (g/mol): 147.13 MDL Number: MFCD00002528 InChI Key: ADCUEPOHPCPMCE-UHFFFAOYSA-N Synonym: p-cyanobenzoic acid,benzoic acid, 4-cyano,p-carboxybenzonitrile,4-carboxybenzonitrile,benzoic acid, p-cyano,4-cyano-benzoic acid,4-cyano benzoic acid,benzoicacid, 4-cyano,4-cyanobenzoicacid,para-cyanobenzoic acid PubChem CID: 12087 IUPAC Name: 4-cyanobenzoic acid SMILES: C1=CC(=CC=C1C#N)C(=O)O

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Specifications

PubChem CID	12087
CAS	619-65-8
Molecular Weight (g/mol)	147.13
MDL Number	MFCD00002528
SMILES	C1=CC(=CC=C1C#N)C(=O)O
Synonym	p-cyanobenzoic acid,benzoic acid, 4-cyano,p-carboxybenzonitrile,4-carboxybenzonitrile,benzoic acid, p-cyano,4-cyano-benzoic acid,4-cyano benzoic acid,benzoicacid, 4-cyano,4-cyanobenzoicacid,para-cyanobenzoic acid
IUPAC Name	4-cyanobenzoic acid
InChI Key	ADCUEPOHPCPMCE-UHFFFAOYSA-N
Molecular Formula	C₈H₅NO₂

3,523

4-Bromobenzenesulfinic acid sodium salt dihydrate, 97%

CAS: 175278-64-5 Molecular Formula: C6H4BrO2S Molecular Weight (g/mol): 220.06 MDL Number: MFCD00210139 InChI Key: QBLQHDHWTVMHRH-UHFFFAOYSA-M Synonym: sodium 4-bromobenzenesulfinate dihydrate,4-bromobenzenesulfinic acid sodium salt dihydrate,sodium 4-bromobenzene-1-sulphinate dihydrate,acmc-209e9v,c6h4bro2s.na.2h2o,sodium 4-bromophenylsulfinate dihydrate,sodium 4-bromobenzenesulfinate, dihydrate,sodium 4-bromanylbenzenesulfinate dihydrate,4-bromobenzenesulfonic acid sodium salt 2-hydrate,sodium 4-bromobenzene-1-sulfinate-water 1/1/2 PubChem CID: 23683129 IUPAC Name: sodium;4-bromobenzenesulfinate;dihydrate SMILES: [O-]S(=O)C1=CC=C(Br)C=C1

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Specifications

PubChem CID	23683129
CAS	175278-64-5
Molecular Weight (g/mol)	220.06
MDL Number	MFCD00210139
SMILES	[O-]S(=O)C1=CC=C(Br)C=C1
Synonym	sodium 4-bromobenzenesulfinate dihydrate,4-bromobenzenesulfinic acid sodium salt dihydrate,sodium 4-bromobenzene-1-sulphinate dihydrate,acmc-209e9v,c6h4bro2s.na.2h2o,sodium 4-bromophenylsulfinate dihydrate,sodium 4-bromobenzenesulfinate, dihydrate,sodium 4-bromanylbenzenesulfinate dihydrate,4-bromobenzenesulfonic acid sodium salt 2-hydrate,sodium 4-bromobenzene-1-sulfinate-water 1/1/2
IUPAC Name	sodium;4-bromobenzenesulfinate;dihydrate
InChI Key	QBLQHDHWTVMHRH-UHFFFAOYSA-M
Molecular Formula	C6H4BrO2S

3,524

2,3,5,6-Tetrafluorobenzotrifluoride, 98%

CAS: 651-80-9 Molecular Formula: C7HF7 Molecular Weight (g/mol): 218.074 MDL Number: MFCD00012385 InChI Key: ZVPAJILXQHMKMT-UHFFFAOYSA-N Synonym: 2,3,5,6-tetrafluorobenzotrifluoride,1,2,4,5-tetrafluoro-3-trifluoromethyl benzene,benzene, 1,2,4,5-tetrafluoro-3-trifluoromethyl,toluene, .alpha.,.alpha.,.alpha.,2,3,5,6-heptafluoro,4h-heptafluorotoluene,1-trifluoromethyl-2,3,5,6-tetrafluorobenzene,2,3,5,6-tetrafluorobenzotrifluoride_x000d_,alpha,alpha,alpha,2,3,5,6-heptafluorotoluene,1,2,4,5-tetrafluoro-3-trifluoromethyl benzene # PubChem CID: 136465 IUPAC Name: 1,2,4,5-tetrafluoro-3-(trifluoromethyl)benzene SMILES: C1=C(C(=C(C(=C1F)F)C(F)(F)F)F)F

Pricing & Availability
Specifications

PubChem CID	136465
CAS	651-80-9
Molecular Weight (g/mol)	218.074
MDL Number	MFCD00012385
SMILES	C1=C(C(=C(C(=C1F)F)C(F)(F)F)F)F
Synonym	2,3,5,6-tetrafluorobenzotrifluoride,1,2,4,5-tetrafluoro-3-trifluoromethyl benzene,benzene, 1,2,4,5-tetrafluoro-3-trifluoromethyl,toluene, .alpha.,.alpha.,.alpha.,2,3,5,6-heptafluoro,4h-heptafluorotoluene,1-trifluoromethyl-2,3,5,6-tetrafluorobenzene,2,3,5,6-tetrafluorobenzotrifluoride_x000d_,alpha,alpha,alpha,2,3,5,6-heptafluorotoluene,1,2,4,5-tetrafluoro-3-trifluoromethyl benzene #
IUPAC Name	1,2,4,5-tetrafluoro-3-(trifluoromethyl)benzene
InChI Key	ZVPAJILXQHMKMT-UHFFFAOYSA-N
Molecular Formula	C7HF7

3,525

4-Fluoro-2-methoxybenzylamine, 97%

CAS: 870563-60-3 Molecular Formula: C8H10FNO Molecular Weight (g/mol): 155.17 MDL Number: MFCD04116361 InChI Key: OUYQGZMPYJPPER-UHFFFAOYSA-N Synonym: 4-fluoro-2-methoxyphenyl methanamine,4-fluoro-2-methoxybenzylamine,2-methoxy-4-fluorobenzylamine,benzenemethanamine, 4-fluoro-2-methoxy,1-4-fluoro-2-methoxyphenyl methanamine,4-fluoro-2-methoxy-benzylamine PubChem CID: 17750694 IUPAC Name: (4-fluoro-2-methoxyphenyl)methanamine SMILES: COC1=C(CN)C=CC(F)=C1

Pricing & Availability
Specifications

PubChem CID	17750694
CAS	870563-60-3
Molecular Weight (g/mol)	155.17
MDL Number	MFCD04116361
SMILES	COC1=C(CN)C=CC(F)=C1
Synonym	4-fluoro-2-methoxyphenyl methanamine,4-fluoro-2-methoxybenzylamine,2-methoxy-4-fluorobenzylamine,benzenemethanamine, 4-fluoro-2-methoxy,1-4-fluoro-2-methoxyphenyl methanamine,4-fluoro-2-methoxy-benzylamine
IUPAC Name	(4-fluoro-2-methoxyphenyl)methanamine
InChI Key	OUYQGZMPYJPPER-UHFFFAOYSA-N
Molecular Formula	C8H10FNO

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