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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6,151 – 6,165 of 57,366 results

6,151

Di-mu-chlorobis[5-chloro-2-[(4-chlorophenyl)(hydroxyimino)methyl]phenyl]palladium(II) Dimer 95.0+%, TCI America™

CAS: 287410-78-0 Molecular Formula: C26H18Cl6N2O2Pd2 Molecular Weight (g/mol): 815.982 MDL Number: MFCD09038424 InChI Key: QPUPWYGEQHWYOF-INIQRQEMSA-N Synonym: Najera Catalyst I PubChem CID: 132774960 IUPAC Name: (NE)-N-[(4-chlorobenzene-6-id-1-yl)-(4-chlorophenyl)methylidene]hydroxylamine;dichloroniopalladium;palladium SMILES: C1=CC(=CC=C1C(=NO)C2=CC=C(C=[C-]2)Cl)Cl.C1=CC(=CC=C1C(=NO)C2=CC=C(C=[C-]2)Cl)Cl.[ClH+][Pd][ClH+].[Pd]

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Specifications

PubChem CID	132774960
CAS	287410-78-0
Molecular Weight (g/mol)	815.982
MDL Number	MFCD09038424
SMILES	C1=CC(=CC=C1C(=NO)C2=CC=C(C=[C-]2)Cl)Cl.C1=CC(=CC=C1C(=NO)C2=CC=C(C=[C-]2)Cl)Cl.[ClH+][Pd][ClH+].[Pd]
Synonym	Najera Catalyst I
IUPAC Name	(NE)-N-[(4-chlorobenzene-6-id-1-yl)-(4-chlorophenyl)methylidene]hydroxylamine;dichloroniopalladium;palladium
InChI Key	QPUPWYGEQHWYOF-INIQRQEMSA-N
Molecular Formula	C26H18Cl6N2O2Pd2

6,152

2-Phenoxymethylbenzoic Acid 98.0+%, TCI America™

CAS: 724-98-1 Molecular Formula: C14H12O3 Molecular Weight (g/mol): 228.247 MDL Number: MFCD00020294 InChI Key: YKNORODREYVARM-UHFFFAOYSA-N Synonym: 2-phenoxymethyl benzoic acid,benzoic acid, 2-phenoxymethyl,alpha-phenoxy-o-toluic acid,unii-nw1f23eg53,o-phenoxymethyl benzoic acid,phenoxymethylbenzoic acid,acmc-1bgx0 PubChem CID: 69761 IUPAC Name: 2-(phenoxymethyl)benzoic acid SMILES: C1=CC=C(C=C1)OCC2=CC=CC=C2C(=O)O

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Specifications

PubChem CID	69761
CAS	724-98-1
Molecular Weight (g/mol)	228.247
MDL Number	MFCD00020294
SMILES	C1=CC=C(C=C1)OCC2=CC=CC=C2C(=O)O
Synonym	2-phenoxymethyl benzoic acid,benzoic acid, 2-phenoxymethyl,alpha-phenoxy-o-toluic acid,unii-nw1f23eg53,o-phenoxymethyl benzoic acid,phenoxymethylbenzoic acid,acmc-1bgx0
IUPAC Name	2-(phenoxymethyl)benzoic acid
InChI Key	YKNORODREYVARM-UHFFFAOYSA-N
Molecular Formula	C14H12O3

6,153

1,3-Bis[(di-tert-butylphosphino)oxy]benzene 94.0+%, TCI America™

CAS: 338800-20-7 Molecular Formula: C22H40O2P2 Molecular Weight (g/mol): 398.51 MDL Number: MFCD28975098 InChI Key: WSKMTURBCLMNEL-UHFFFAOYSA-N PubChem CID: 12992261 IUPAC Name: 3-[(di-tert-butylphosphanyl)oxy]phenyl di-tert-butylphosphinite SMILES: CC(C)(C)P(OC1=CC(OP(C(C)(C)C)C(C)(C)C)=CC=C1)C(C)(C)C

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Specifications

PubChem CID	12992261
CAS	338800-20-7
Molecular Weight (g/mol)	398.51
MDL Number	MFCD28975098
SMILES	CC(C)(C)P(OC1=CC(OP(C(C)(C)C)C(C)(C)C)=CC=C1)C(C)(C)C
IUPAC Name	3-[(di-tert-butylphosphanyl)oxy]phenyl di-tert-butylphosphinite
InChI Key	WSKMTURBCLMNEL-UHFFFAOYSA-N
Molecular Formula	C22H40O2P2

6,154

1,4-Dimethoxy-2-nitrobenzene 99.0+%, TCI America™

CAS: 89-39-4 Molecular Formula: C8H9NO4 Molecular Weight (g/mol): 183.163 MDL Number: MFCD00024211 InChI Key: UPTOWXNJLZJTGD-UHFFFAOYSA-N Synonym: Nitrodimethylhydroquinone, 2-Nitrohydroquinone Dimethyl Ether PubChem CID: 66639 IUPAC Name: 1,4-dimethoxy-2-nitrobenzene SMILES: COC1=CC(=C(C=C1)OC)[N+](=O)[O-]

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Specifications

PubChem CID	66639
CAS	89-39-4
Molecular Weight (g/mol)	183.163
MDL Number	MFCD00024211
SMILES	COC1=CC(=C(C=C1)OC)[N+](=O)[O-]
Synonym	Nitrodimethylhydroquinone, 2-Nitrohydroquinone Dimethyl Ether
IUPAC Name	1,4-dimethoxy-2-nitrobenzene
InChI Key	UPTOWXNJLZJTGD-UHFFFAOYSA-N
Molecular Formula	C8H9NO4

6,155

Neostigmine Methyl Sulfate 98.0+%, TCI America™

CAS: 51-60-5 Molecular Formula: C13H22N2O6S Molecular Weight (g/mol): 334.387 MDL Number: MFCD00011796 InChI Key: OSZNNLWOYWAHSS-UHFFFAOYSA-M Synonym: (3-Dimethylcarbamoyloxyphenyl)trimethylammonium Methyl Sulfate, (3-Hydroxyphenyl)trimethylammonium Methyl Sulfate Dimethylcarbamate PubChem CID: 5824 ChEBI: CHEBI:7516 IUPAC Name: [3-(dimethylcarbamoyloxy)phenyl]-trimethylazanium;methyl sulfate SMILES: CN(C)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C.COS(=O)(=O)[O-]

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Specifications

PubChem CID	5824
CAS	51-60-5
Molecular Weight (g/mol)	334.387
ChEBI	CHEBI:7516
MDL Number	MFCD00011796
SMILES	CN(C)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C.COS(=O)(=O)[O-]
Synonym	(3-Dimethylcarbamoyloxyphenyl)trimethylammonium Methyl Sulfate, (3-Hydroxyphenyl)trimethylammonium Methyl Sulfate Dimethylcarbamate
IUPAC Name	[3-(dimethylcarbamoyloxy)phenyl]-trimethylazanium;methyl sulfate
InChI Key	OSZNNLWOYWAHSS-UHFFFAOYSA-M
Molecular Formula	C13H22N2O6S

6,156

[(Oxido)phenyl(trifluoromethyl)-lambda4-sulfanylidene]dimethylammonium Tetrafluoroborate 98.0+%, TCI America™

CAS: 1046786-08-6 Molecular Formula: C9H11BF7NOS Synonym: Shibata Reagent I

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Specifications

CAS	1046786-08-6
Synonym	Shibata Reagent I
Molecular Formula	C9H11BF7NOS

6,157

trans,trans-4-(3,4-Difluorophenyl)-4'-propylbicyclohexyl 98.0+%, TCI America™

CAS: 82832-57-3 Molecular Formula: C21H30F2 Molecular Weight (g/mol): 320.468 MDL Number: MFCD09838997 InChI Key: FSWZOZXLWVWJAH-UHFFFAOYSA-N Synonym: trans,trans-4-3,4-difluorophenyl-4'-propyl-1,1'-bi cyclohexane,1,2-difluoro-4-4-4-propylcyclohexyl cyclohexyl benzene,trans,trans-4-3,4-difluorophenyl-4-propylbicyclohexyl,trans,trans-4-3,4-difluorophenyl-4'-propyl-bicyclohexyl,4-3,4-difluoro-phenyl-4'-propyl-bicyclohexyl,4-3,4-difluorophenyl-4'-propyl-1,1'-bi cyclohexyl,trans,trans-4-3,4-difluorophenyl-4'-n-propylbicyclohexyl,benzene, 1,2-difluoro-4-trans,trans-4'-propyl 1,1'-bicyclohexyl-4-yl,4-3,4-difluorophenyl-4'-propyl-1,1'-bi cyclohexane,4-3,4-difluorophenyl-4'-propyl-bicyclohexyl PubChem CID: 581325 IUPAC Name: 1,2-difluoro-4-[4-(4-propylcyclohexyl)cyclohexyl]benzene SMILES: CCCC1CCC(CC1)C2CCC(CC2)C3=CC(=C(C=C3)F)F

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Specifications

PubChem CID	581325
CAS	82832-57-3
Molecular Weight (g/mol)	320.468
MDL Number	MFCD09838997
SMILES	CCCC1CCC(CC1)C2CCC(CC2)C3=CC(=C(C=C3)F)F
Synonym	trans,trans-4-3,4-difluorophenyl-4'-propyl-1,1'-bi cyclohexane,1,2-difluoro-4-4-4-propylcyclohexyl cyclohexyl benzene,trans,trans-4-3,4-difluorophenyl-4-propylbicyclohexyl,trans,trans-4-3,4-difluorophenyl-4'-propyl-bicyclohexyl,4-3,4-difluoro-phenyl-4'-propyl-bicyclohexyl,4-3,4-difluorophenyl-4'-propyl-1,1'-bi cyclohexyl,trans,trans-4-3,4-difluorophenyl-4'-n-propylbicyclohexyl,benzene, 1,2-difluoro-4-trans,trans-4'-propyl 1,1'-bicyclohexyl-4-yl,4-3,4-difluorophenyl-4'-propyl-1,1'-bi cyclohexane,4-3,4-difluorophenyl-4'-propyl-bicyclohexyl
IUPAC Name	1,2-difluoro-4-[4-(4-propylcyclohexyl)cyclohexyl]benzene
InChI Key	FSWZOZXLWVWJAH-UHFFFAOYSA-N
Molecular Formula	C21H30F2

6,158

p-Tolylthiourea 98.0+%, TCI America™

CAS: 622-52-6 Molecular Formula: C8H10N2S Molecular Weight (g/mol): 166.24 MDL Number: MFCD00041190 InChI Key: VXLFMCZPFIKKDZ-UHFFFAOYSA-N Synonym: p-tolylthiourea,1-p-tolyl thiourea,1-p-tolylthiourea,1-4-methylphenyl thiourea,n-4-methylphenyl thiourea,4-methylphenyl thiourea,urea, 2-thio-1-p-tolyl,n-p-tolylthiourea,p-tolylthiocarbamide,thiourea, 4-methylphenyl PubChem CID: 722833 IUPAC Name: (4-methylphenyl)thiourea SMILES: CC1=CC=C(NC(N)=S)C=C1

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Specifications

PubChem CID	722833
CAS	622-52-6
Molecular Weight (g/mol)	166.24
MDL Number	MFCD00041190
SMILES	CC1=CC=C(NC(N)=S)C=C1
Synonym	p-tolylthiourea,1-p-tolyl thiourea,1-p-tolylthiourea,1-4-methylphenyl thiourea,n-4-methylphenyl thiourea,4-methylphenyl thiourea,urea, 2-thio-1-p-tolyl,n-p-tolylthiourea,p-tolylthiocarbamide,thiourea, 4-methylphenyl
IUPAC Name	(4-methylphenyl)thiourea
InChI Key	VXLFMCZPFIKKDZ-UHFFFAOYSA-N
Molecular Formula	C8H10N2S

6,159

(E)-3-(4-Amino-3,5-dimethylphenyl)acrylonitrile Hydrochloride 98.0+%, TCI America™

CAS: 661489-23-2 Molecular Formula: C11H13ClN2 Molecular Weight (g/mol): 208.689 MDL Number: MFCD18711816 InChI Key: DHBOHGCHPDMVOD-BJILWQEISA-N Synonym: (E)-3-(4-Amino-3,5-dimethylphenyl)-2-propenenitrile Hydrochloride PubChem CID: 68291229 IUPAC Name: (E)-3-(4-amino-3,5-dimethylphenyl)prop-2-enenitrile;hydrochloride SMILES: CC1=CC(=CC(=C1N)C)C=CC#N.Cl

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Specifications

PubChem CID	68291229
CAS	661489-23-2
Molecular Weight (g/mol)	208.689
MDL Number	MFCD18711816
SMILES	CC1=CC(=CC(=C1N)C)C=CC#N.Cl
Synonym	(E)-3-(4-Amino-3,5-dimethylphenyl)-2-propenenitrile Hydrochloride
IUPAC Name	(E)-3-(4-amino-3,5-dimethylphenyl)prop-2-enenitrile;hydrochloride
InChI Key	DHBOHGCHPDMVOD-BJILWQEISA-N
Molecular Formula	C11H13ClN2

6,160

sec-Butyl 4-Hydroxybenzoate 98.0+%, TCI America™

CAS: 17696-61-6 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00059626 InChI Key: ZUOTXZHOGPQFIU-UHFFFAOYSA-N Synonym: 4-Hydroxybenzoic Acid sec-Butyl Ester, sec-Butylparaben PubChem CID: 86607 IUPAC Name: butan-2-yl 4-hydroxybenzoate SMILES: CCC(C)OC(=O)C1=CC=C(C=C1)O

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Specifications

PubChem CID	86607
CAS	17696-61-6
Molecular Weight (g/mol)	194.23
MDL Number	MFCD00059626
SMILES	CCC(C)OC(=O)C1=CC=C(C=C1)O
Synonym	4-Hydroxybenzoic Acid sec-Butyl Ester, sec-Butylparaben
IUPAC Name	butan-2-yl 4-hydroxybenzoate
InChI Key	ZUOTXZHOGPQFIU-UHFFFAOYSA-N
Molecular Formula	C11H14O3

6,161

2-Fluorophenylsulfur Pentafluoride 97.0+%, TCI America™

CAS: 864230-02-4 Molecular Formula: C6H4F6S Molecular Weight (g/mol): 222.148 MDL Number: MFCD18909664 InChI Key: MHUHQWYOEMJKBC-UHFFFAOYSA-N PubChem CID: 12174437 IUPAC Name: pentafluoro-(2-fluorophenyl)-$l^{6}-sulfane SMILES: C1=CC=C(C(=C1)F)S(F)(F)(F)(F)F

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Specifications

PubChem CID	12174437
CAS	864230-02-4
Molecular Weight (g/mol)	222.148
MDL Number	MFCD18909664
SMILES	C1=CC=C(C(=C1)F)S(F)(F)(F)(F)F
IUPAC Name	pentafluoro-(2-fluorophenyl)-$l^{6}-sulfane
InChI Key	MHUHQWYOEMJKBC-UHFFFAOYSA-N
Molecular Formula	C6H4F6S

6,162

1,4-Bis(bromomethyl)-2,5-dimethylbenzene 98.0+%, TCI America™

CAS: 35168-62-8 Molecular Formula: C10H12Br2 Molecular Weight (g/mol): 292.014 MDL Number: MFCD04038409 InChI Key: MUSYLRHTIZVVCB-UHFFFAOYSA-N Synonym: 2,5-Bis(bromomethyl)-p-xylene, 2,5-Dimethyl-1,4-bis(bromomethyl)benzene PubChem CID: 3015742 IUPAC Name: 1,4-bis(bromomethyl)-2,5-dimethylbenzene SMILES: CC1=CC(=C(C=C1CBr)C)CBr

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Specifications

PubChem CID	3015742
CAS	35168-62-8
Molecular Weight (g/mol)	292.014
MDL Number	MFCD04038409
SMILES	CC1=CC(=C(C=C1CBr)C)CBr
Synonym	2,5-Bis(bromomethyl)-p-xylene, 2,5-Dimethyl-1,4-bis(bromomethyl)benzene
IUPAC Name	1,4-bis(bromomethyl)-2,5-dimethylbenzene
InChI Key	MUSYLRHTIZVVCB-UHFFFAOYSA-N
Molecular Formula	C10H12Br2

6,163

2,4,6-Trimethylstyrene (stabilized with TBC) 97.0+%, TCI America™

CAS: 769-25-5 Molecular Formula: C11H14 Molecular Weight (g/mol): 146.233 MDL Number: MFCD00008613 InChI Key: PDELBHCVXBSVPJ-UHFFFAOYSA-N Synonym: 2,4,6-trimethylstyrene,1,3,5-trimethyl-2-vinylbenzene,2-vinylmesitylene,mesitylethylene,vinylmesitylene,styrene, 2,4,6-trimethyl,unii-89fv7yq871,benzene, 2-ethenyl-1,3,5-trimethyl,2,6-trimethylstyrene,styrene,4,6-trimethyl PubChem CID: 13036 IUPAC Name: 2-ethenyl-1,3,5-trimethylbenzene SMILES: CC1=CC(=C(C(=C1)C)C=C)C

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Specifications

PubChem CID	13036
CAS	769-25-5
Molecular Weight (g/mol)	146.233
MDL Number	MFCD00008613
SMILES	CC1=CC(=C(C(=C1)C)C=C)C
Synonym	2,4,6-trimethylstyrene,1,3,5-trimethyl-2-vinylbenzene,2-vinylmesitylene,mesitylethylene,vinylmesitylene,styrene, 2,4,6-trimethyl,unii-89fv7yq871,benzene, 2-ethenyl-1,3,5-trimethyl,2,6-trimethylstyrene,styrene,4,6-trimethyl
IUPAC Name	2-ethenyl-1,3,5-trimethylbenzene
InChI Key	PDELBHCVXBSVPJ-UHFFFAOYSA-N
Molecular Formula	C11H14

6,164

2,4,6-Trichlorobenzoyl Chloride 98.0+%, TCI America™

CAS: 4136-95-2 Molecular Formula: C7H2Cl4O Molecular Weight (g/mol): 243.89 MDL Number: MFCD00075323 InChI Key: OZGSEIVTQLXWRO-UHFFFAOYSA-N Synonym: 2,4,6-trichlorobenzoylchloride,benzoyl chloride, 2,4,6-trichloro,mi,acmc-209jk3,ksc494s2p,2,4,6-cl3c6h2cocl,2,4,6-ttrichlorobenzoyl chloride,2,4,6-trichloro benzoyl chloride,2,4,6-trichlorobenzoic acid chloride,2,4,6-tris chloranyl benzoyl chloride PubChem CID: 2733703 IUPAC Name: 2,4,6-trichlorobenzoyl chloride SMILES: ClC(=O)C1=C(Cl)C=C(Cl)C=C1Cl

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Specifications

PubChem CID	2733703
CAS	4136-95-2
Molecular Weight (g/mol)	243.89
MDL Number	MFCD00075323
SMILES	ClC(=O)C1=C(Cl)C=C(Cl)C=C1Cl
Synonym	2,4,6-trichlorobenzoylchloride,benzoyl chloride, 2,4,6-trichloro,mi,acmc-209jk3,ksc494s2p,2,4,6-cl3c6h2cocl,2,4,6-ttrichlorobenzoyl chloride,2,4,6-trichloro benzoyl chloride,2,4,6-trichlorobenzoic acid chloride,2,4,6-tris chloranyl benzoyl chloride
IUPAC Name	2,4,6-trichlorobenzoyl chloride
InChI Key	OZGSEIVTQLXWRO-UHFFFAOYSA-N
Molecular Formula	C7H2Cl4O

6,165

4-Phenoxyphenol 99.0+%, TCI America™

CAS: 831-82-3 Molecular Formula: C12H10O2 Molecular Weight (g/mol): 186.21 MDL Number: MFCD00002331 InChI Key: ZSBDGXGICLIJGD-UHFFFAOYSA-N Synonym: p-phenoxyphenol,4-hydroxydiphenyl ether,phenol, 4-phenoxy,p-hydroxydiphenyl ether,phenol, p-phenoxy,hydroquinone monophenyl ether,unii-d83r742gjr,4-phenyloxy phenol,4-phenoxy phenol,4-phenoxy-phenol PubChem CID: 13254 ChEBI: CHEBI:39264 IUPAC Name: 4-phenoxyphenol SMILES: C1=CC=C(C=C1)OC2=CC=C(C=C2)O

Pricing & Availability
Specifications

PubChem CID	13254
CAS	831-82-3
Molecular Weight (g/mol)	186.21
ChEBI	CHEBI:39264
MDL Number	MFCD00002331
SMILES	C1=CC=C(C=C1)OC2=CC=C(C=C2)O
Synonym	p-phenoxyphenol,4-hydroxydiphenyl ether,phenol, 4-phenoxy,p-hydroxydiphenyl ether,phenol, p-phenoxy,hydroquinone monophenyl ether,unii-d83r742gjr,4-phenyloxy phenol,4-phenoxy phenol,4-phenoxy-phenol
IUPAC Name	4-phenoxyphenol
InChI Key	ZSBDGXGICLIJGD-UHFFFAOYSA-N
Molecular Formula	C12H10O2

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Benzene and substituted derivatives

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