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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6,091 – 6,105 of 57,426 results

6,091

2-Hydroxy-4-n-octyloxybenzophenone 98.0+%, TCI America™

CAS: 1843-05-6 Molecular Formula: C21H26O3 Molecular Weight (g/mol): 326.436 MDL Number: MFCD00027327 InChI Key: QUAMTGJKVDWJEQ-UHFFFAOYSA-N Synonym: octabenzone,2-hydroxy-4-n-octyloxybenzophenone,benzophenone-12,2-hydroxy-4-octyloxy phenyl phenyl methanone,benzon oo,2-hydroxy-4-octyloxy benzophenone,benzophenone 12,cyasorb uv 531,spectra-sorb uv 531,sumisorb 130 PubChem CID: 15797 IUPAC Name: (2-hydroxy-4-octoxyphenyl)-phenylmethanone SMILES: CCCCCCCCOC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O

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Specifications

PubChem CID	15797
CAS	1843-05-6
Molecular Weight (g/mol)	326.436
MDL Number	MFCD00027327
SMILES	CCCCCCCCOC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O
Synonym	octabenzone,2-hydroxy-4-n-octyloxybenzophenone,benzophenone-12,2-hydroxy-4-octyloxy phenyl phenyl methanone,benzon oo,2-hydroxy-4-octyloxy benzophenone,benzophenone 12,cyasorb uv 531,spectra-sorb uv 531,sumisorb 130
IUPAC Name	(2-hydroxy-4-octoxyphenyl)-phenylmethanone
InChI Key	QUAMTGJKVDWJEQ-UHFFFAOYSA-N
Molecular Formula	C21H26O3

6,092

4-Phenylbenzophenone 98.0+%, TCI America™

CAS: 2128-93-0 Molecular Formula: C19H14O Molecular Weight (g/mol): 258.32 MDL Number: MFCD00003079 InChI Key: LYXOWKPVTCPORE-UHFFFAOYSA-N Synonym: 4-benzoylbiphenyl,4-phenylbenzophenone,p-phenylbenzophenone,benzophenone, 4-phenyl,p-benzoylbiphenyl,4-diphenyl phenyl ketone,p-biphenylyl phenyl ketone,trigonal 12,4-biphenylyl phenyl ketone,methanone, 1,1'-biphenyl-4-ylphenyl PubChem CID: 75040 IUPAC Name: phenyl-(4-phenylphenyl)methanone SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C3=CC=CC=C3

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Specifications

PubChem CID	75040
CAS	2128-93-0
Molecular Weight (g/mol)	258.32
MDL Number	MFCD00003079
SMILES	C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C3=CC=CC=C3
Synonym	4-benzoylbiphenyl,4-phenylbenzophenone,p-phenylbenzophenone,benzophenone, 4-phenyl,p-benzoylbiphenyl,4-diphenyl phenyl ketone,p-biphenylyl phenyl ketone,trigonal 12,4-biphenylyl phenyl ketone,methanone, 1,1'-biphenyl-4-ylphenyl
IUPAC Name	phenyl-(4-phenylphenyl)methanone
InChI Key	LYXOWKPVTCPORE-UHFFFAOYSA-N
Molecular Formula	C19H14O

6,093

2,2',4,4'-Tetrahydroxybenzophenone 98.0+%, TCI America™

CAS: 131-55-5 Molecular Formula: C13H10O5 Molecular Weight (g/mol): 246.218 MDL Number: MFCD00002278 InChI Key: WXNRYSGJLQFHBR-UHFFFAOYSA-N Synonym: 2,2',4,4'-tetrahydroxybenzophenone,bis 2,4-dihydroxyphenyl methanone,benzophenone-2,uvinol d-50,uvinul d-50,methanone, bis 2,4-dihydroxyphenyl,2,4,2',4'-tetrahydroxybenzophenone,unii-prr8k3h9vn,2,2',4,4'-tetrehydroxybenzophenone,prr8k3h9vn PubChem CID: 8571 IUPAC Name: bis(2,4-dihydroxyphenyl)methanone SMILES: C1=CC(=C(C=C1O)O)C(=O)C2=C(C=C(C=C2)O)O

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Specifications

PubChem CID	8571
CAS	131-55-5
Molecular Weight (g/mol)	246.218
MDL Number	MFCD00002278
SMILES	C1=CC(=C(C=C1O)O)C(=O)C2=C(C=C(C=C2)O)O
Synonym	2,2',4,4'-tetrahydroxybenzophenone,bis 2,4-dihydroxyphenyl methanone,benzophenone-2,uvinol d-50,uvinul d-50,methanone, bis 2,4-dihydroxyphenyl,2,4,2',4'-tetrahydroxybenzophenone,unii-prr8k3h9vn,2,2',4,4'-tetrehydroxybenzophenone,prr8k3h9vn
IUPAC Name	bis(2,4-dihydroxyphenyl)methanone
InChI Key	WXNRYSGJLQFHBR-UHFFFAOYSA-N
Molecular Formula	C13H10O5

6,094

2,4-Bis[8-hydroxy-1,1,7,7-tetramethyljulolidin-9-yl]squaraine 98.0+%, TCI America™

CAS: 358727-55-6 Molecular Formula: C36H44N2O4-2 Molecular Weight (g/mol): 568.758 InChI Key: ZVJJZBXHRPLGNI-UHFFFAOYSA-L Synonym: 2,4-Bis[8-hydroxy-1,1,7,7-tetramethyl-1,2,3,5,6,7-hexahydropyrido[3,2,1-ij]quinoline-9-yl]squaraine PubChem CID: 91972175 SMILES: CC1(CCN2CCC(C3=C(C(=CC1=C32)C4=C(C(=C4O)C5=CC6=C7C(=C5[O-])C(CCN7CCC6(C)C)(C)C)O)[O-])(C)C)C

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Specifications

PubChem CID	91972175
CAS	358727-55-6
Molecular Weight (g/mol)	568.758
SMILES	CC1(CCN2CCC(C3=C(C(=CC1=C32)C4=C(C(=C4O)C5=CC6=C7C(=C5[O-])C(CCN7CCC6(C)C)(C)C)O)[O-])(C)C)C
Synonym	2,4-Bis[8-hydroxy-1,1,7,7-tetramethyl-1,2,3,5,6,7-hexahydropyrido[3,2,1-ij]quinoline-9-yl]squaraine
InChI Key	ZVJJZBXHRPLGNI-UHFFFAOYSA-L
Molecular Formula	C36H44N2O4-2

6,095

Tetrabromofluorescein Potassium Salt 85.0+%, TCI America™

CAS: 56897-54-2 Molecular Formula: C20H6Br4K2O5 Molecular Weight (g/mol): 724.076 MDL Number: MFCD00070510 InChI Key: GZAAPEKTGHKWRZ-UHFFFAOYSA-L PubChem CID: 12598436 IUPAC Name: dipotassium;2-(2,4,5,7-tetrabromo-3-oxido-6-oxoxanthen-9-yl)benzoate SMILES: C1=CC=C(C(=C1)C2=C3C=C(C(=O)C(=C3OC4=C(C(=C(C=C24)Br)[O-])Br)Br)Br)C(=O)[O-].[K+].[K+]

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Specifications

PubChem CID	12598436
CAS	56897-54-2
Molecular Weight (g/mol)	724.076
MDL Number	MFCD00070510
SMILES	C1=CC=C(C(=C1)C2=C3C=C(C(=O)C(=C3OC4=C(C(=C(C=C24)Br)[O-])Br)Br)Br)C(=O)[O-].[K+].[K+]
IUPAC Name	dipotassium;2-(2,4,5,7-tetrabromo-3-oxido-6-oxoxanthen-9-yl)benzoate
InChI Key	GZAAPEKTGHKWRZ-UHFFFAOYSA-L
Molecular Formula	C20H6Br4K2O5

6,096

[(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

6,097

4-Hexyloxyphthalonitrile 95.0+%, TCI America™

CAS: 104949-82-8 Molecular Formula: C14H16N2O Molecular Weight (g/mol): 228.295 MDL Number: MFCD00059077 InChI Key: BMXSATBWGFIAPA-UHFFFAOYSA-N Synonym: 1,2-Dicyano-4-hexyloxybenzene PubChem CID: 538284 IUPAC Name: 4-hexoxybenzene-1,2-dicarbonitrile SMILES: CCCCCCOC1=CC(=C(C=C1)C#N)C#N

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Specifications

PubChem CID	538284
CAS	104949-82-8
Molecular Weight (g/mol)	228.295
MDL Number	MFCD00059077
SMILES	CCCCCCOC1=CC(=C(C=C1)C#N)C#N
Synonym	1,2-Dicyano-4-hexyloxybenzene
IUPAC Name	4-hexoxybenzene-1,2-dicarbonitrile
InChI Key	BMXSATBWGFIAPA-UHFFFAOYSA-N
Molecular Formula	C14H16N2O

6,098

2,6-Dichloro-4-(trifluoromethoxy)aniline 98.0+%, TCI America™

CAS: 99479-66-0 Molecular Formula: C7H4Cl2F3NO Molecular Weight (g/mol): 246.01 MDL Number: MFCD00190128 InChI Key: FKISQWQHZULEEG-UHFFFAOYSA-N Synonym: 2,6-dichloro-4-trifluoromethoxy aniline,benzenamine, 2,6-dichloro-4-trifluoromethoxy,2,6-dichloro-4-trifluoromethoxy phenylamine,pubchem8461,acmc-209scs,3.5-dichloro-4-amino trifluoromethoxybenzene,2,6-dichloro-4-trifluoromethoxy-phenylamine,3,5-dichloro-4-amino trifluoromethoxybenzene,3,5-dichloro-4-aminotrifluoromethoxy benzene,2,6-dichloro-4-trifluoromethoxy benzenamine PubChem CID: 688247 IUPAC Name: 2,6-dichloro-4-(trifluoromethoxy)aniline SMILES: NC1=C(Cl)C=C(OC(F)(F)F)C=C1Cl

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Specifications

PubChem CID	688247
CAS	99479-66-0
Molecular Weight (g/mol)	246.01
MDL Number	MFCD00190128
SMILES	NC1=C(Cl)C=C(OC(F)(F)F)C=C1Cl
Synonym	2,6-dichloro-4-trifluoromethoxy aniline,benzenamine, 2,6-dichloro-4-trifluoromethoxy,2,6-dichloro-4-trifluoromethoxy phenylamine,pubchem8461,acmc-209scs,3.5-dichloro-4-amino trifluoromethoxybenzene,2,6-dichloro-4-trifluoromethoxy-phenylamine,3,5-dichloro-4-amino trifluoromethoxybenzene,3,5-dichloro-4-aminotrifluoromethoxy benzene,2,6-dichloro-4-trifluoromethoxy benzenamine
IUPAC Name	2,6-dichloro-4-(trifluoromethoxy)aniline
InChI Key	FKISQWQHZULEEG-UHFFFAOYSA-N
Molecular Formula	C7H4Cl2F3NO

6,099

Phenyl Methanesulfonate 98.0+%, TCI America™

CAS: 16156-59-5 Molecular Formula: C7H8O3S Molecular Weight (g/mol): 172.20 MDL Number: MFCD00095143 InChI Key: WXVUCMFEGJUVTN-UHFFFAOYSA-N Synonym: phenyl methylsulfonate,phenyl methyl sulfonate,acmc-1bs7l,phenylmethanesulfonate 4,phenyl methanesulfonate,methanesulfonic acid,phenyl ester,methanesulfonic acid phenyl ester,methanesulfonic acid, phenyl ester PubChem CID: 316170 IUPAC Name: phenyl methanesulfonate SMILES: CS(=O)(=O)OC1=CC=CC=C1

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Specifications

PubChem CID	316170
CAS	16156-59-5
Molecular Weight (g/mol)	172.20
MDL Number	MFCD00095143
SMILES	CS(=O)(=O)OC1=CC=CC=C1
Synonym	phenyl methylsulfonate,phenyl methyl sulfonate,acmc-1bs7l,phenylmethanesulfonate 4,phenyl methanesulfonate,methanesulfonic acid,phenyl ester,methanesulfonic acid phenyl ester,methanesulfonic acid, phenyl ester
IUPAC Name	phenyl methanesulfonate
InChI Key	WXVUCMFEGJUVTN-UHFFFAOYSA-N
Molecular Formula	C7H8O3S

6,100

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

CAS: 2312-15-4 Molecular Formula: C19H30O3 Molecular Weight (g/mol): 306.45 MDL Number: MFCD00002543 InChI Key: ALQLYJHDBAKLBB-UHFFFAOYSA-N Synonym: 4-dodecyloxy benzoic acid,p-dodecyloxybenzoic acid,4-n-dodecyloxybenzoic acid,4-dodecyloxybenzoic acid,benzoic acid, 4-dodecyloxy,benzoic acid, p-dodecyloxy,p-dodecyloxy benzoic acid,4-dodecyloxy benzoicacid,pubchem2685,acmc-1crse PubChem CID: 75330 IUPAC Name: 4-(dodecyloxy)benzoic acid SMILES: CCCCCCCCCCCCOC1=CC=C(C=C1)C(O)=O

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Specifications

PubChem CID	75330
CAS	2312-15-4
Molecular Weight (g/mol)	306.45
MDL Number	MFCD00002543
SMILES	CCCCCCCCCCCCOC1=CC=C(C=C1)C(O)=O
Synonym	4-dodecyloxy benzoic acid,p-dodecyloxybenzoic acid,4-n-dodecyloxybenzoic acid,4-dodecyloxybenzoic acid,benzoic acid, 4-dodecyloxy,benzoic acid, p-dodecyloxy,p-dodecyloxy benzoic acid,4-dodecyloxy benzoicacid,pubchem2685,acmc-1crse
IUPAC Name	4-(dodecyloxy)benzoic acid
InChI Key	ALQLYJHDBAKLBB-UHFFFAOYSA-N
Molecular Formula	C19H30O3

6,101

2-(Trifluoromethoxy)benzoic Acid 98.0+%, TCI America™

CAS: 1979-29-9 Molecular Formula: C8H4F3O3 Molecular Weight (g/mol): 205.11 MDL Number: MFCD00052325 InChI Key: JMYSPFGUBNENSE-UHFFFAOYSA-M Synonym: 2-trifluoromethoxy benzoic acid,o-trifluoromethoxybenzoic acid,alpha,alpha,alpha-trifluoro-o-anisic acid,2-trifluoromethoxy-benzoic acid,rarechem al bo 0449,pubchem4587,acmc-209f2a,ksc494o7t PubChem CID: 2777223 IUPAC Name: 2-(trifluoromethoxy)benzoate SMILES: [O-]C(=O)C1=CC=CC=C1OC(F)(F)F

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Specifications

PubChem CID	2777223
CAS	1979-29-9
Molecular Weight (g/mol)	205.11
MDL Number	MFCD00052325
SMILES	[O-]C(=O)C1=CC=CC=C1OC(F)(F)F
Synonym	2-trifluoromethoxy benzoic acid,o-trifluoromethoxybenzoic acid,alpha,alpha,alpha-trifluoro-o-anisic acid,2-trifluoromethoxy-benzoic acid,rarechem al bo 0449,pubchem4587,acmc-209f2a,ksc494o7t
IUPAC Name	2-(trifluoromethoxy)benzoate
InChI Key	JMYSPFGUBNENSE-UHFFFAOYSA-M
Molecular Formula	C8H4F3O3

6,102

Tri-o-tolyl Phosphite 97.0+%, TCI America™

CAS: 2622-08-4 Molecular Formula: C21H21O3P Molecular Weight (g/mol): 352.37 MDL Number: MFCD00014911 InChI Key: BKHZQJRTFNFCTG-UHFFFAOYSA-N Synonym: tri-o-tolyl phosphite,tri-o-tolylphosphite,tri-o-cresyl phosphite,phosphorous acid tri-o-cresyl ester,tris o-methylphenyl phosphite,tris 2-methylphenyl phosphite,tris 2-tolyl phosphite,tris o-tolyloxy phosphine,phosphorous acid, tri-o-cresyl ester,tri-2-tolylphosphite PubChem CID: 92937 IUPAC Name: tris(2-methylphenyl) phosphite SMILES: CC1=CC=CC=C1OP(OC1=CC=CC=C1C)OC1=CC=CC=C1C

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Specifications

PubChem CID	92937
CAS	2622-08-4
Molecular Weight (g/mol)	352.37
MDL Number	MFCD00014911
SMILES	CC1=CC=CC=C1OP(OC1=CC=CC=C1C)OC1=CC=CC=C1C
Synonym	tri-o-tolyl phosphite,tri-o-tolylphosphite,tri-o-cresyl phosphite,phosphorous acid tri-o-cresyl ester,tris o-methylphenyl phosphite,tris 2-methylphenyl phosphite,tris 2-tolyl phosphite,tris o-tolyloxy phosphine,phosphorous acid, tri-o-cresyl ester,tri-2-tolylphosphite
IUPAC Name	tris(2-methylphenyl) phosphite
InChI Key	BKHZQJRTFNFCTG-UHFFFAOYSA-N
Molecular Formula	C21H21O3P

6,103

1,3-Diethoxybenzene 97.0+%, TCI America™

CAS: 2049-73-2 Molecular Formula: C10H14O2 Molecular Weight (g/mol): 166.22 MDL Number: MFCD00015145 InChI Key: MKGFYMKFBCWNCP-UHFFFAOYSA-N Synonym: m-diethoxybenzene,benzene, 1,3-diethoxy,resorcinol diethyl ether,resorcindiathylather,benzene,3-diethoxy,acmc-1cdp4,benzene, 1,3-diethoxy-9ci PubChem CID: 74899 IUPAC Name: 1,3-diethoxybenzene SMILES: CCOC1=CC(=CC=C1)OCC

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Specifications

PubChem CID	74899
CAS	2049-73-2
Molecular Weight (g/mol)	166.22
MDL Number	MFCD00015145
SMILES	CCOC1=CC(=CC=C1)OCC
Synonym	m-diethoxybenzene,benzene, 1,3-diethoxy,resorcinol diethyl ether,resorcindiathylather,benzene,3-diethoxy,acmc-1cdp4,benzene, 1,3-diethoxy-9ci
IUPAC Name	1,3-diethoxybenzene
InChI Key	MKGFYMKFBCWNCP-UHFFFAOYSA-N
Molecular Formula	C10H14O2

6,104

1-(2-Methylphenoxy)-2-propanol 90.0+%, TCI America™

CAS: 4317-61-7 Molecular Formula: C10H14O2 Molecular Weight (g/mol): 166.22 MDL Number: MFCD00191542 InChI Key: ISIQEWJJVXFCDP-UHFFFAOYSA-N Synonym: 1-(o-Tolyloxy)-2-propanol PubChem CID: 107264 IUPAC Name: 1-(2-methylphenoxy)propan-2-ol SMILES: CC1=CC=CC=C1OCC(C)O

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Specifications

PubChem CID	107264
CAS	4317-61-7
Molecular Weight (g/mol)	166.22
MDL Number	MFCD00191542
SMILES	CC1=CC=CC=C1OCC(C)O
Synonym	1-(o-Tolyloxy)-2-propanol
IUPAC Name	1-(2-methylphenoxy)propan-2-ol
InChI Key	ISIQEWJJVXFCDP-UHFFFAOYSA-N
Molecular Formula	C10H14O2

6,105

1,10-Bis(4-carboxyphenoxy)decane 97.0+%, TCI America™

CAS: 74774-61-1 Molecular Formula: C24H30O6 Molecular Weight (g/mol): 414.498 MDL Number: MFCD00142356 InChI Key: XRDKWFXOXXUQJS-UHFFFAOYSA-N Synonym: p,p′C-Dicarboxy-1,10-diphenoxydecane PubChem CID: 400760 IUPAC Name: 4-[10-(4-carboxyphenoxy)decoxy]benzoic acid SMILES: C1=CC(=CC=C1C(=O)O)OCCCCCCCCCCOC2=CC=C(C=C2)C(=O)O

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Specifications

PubChem CID	400760
CAS	74774-61-1
Molecular Weight (g/mol)	414.498
MDL Number	MFCD00142356
SMILES	C1=CC(=CC=C1C(=O)O)OCCCCCCCCCCOC2=CC=C(C=C2)C(=O)O
Synonym	p,p′C-Dicarboxy-1,10-diphenoxydecane
IUPAC Name	4-[10-(4-carboxyphenoxy)decoxy]benzoic acid
InChI Key	XRDKWFXOXXUQJS-UHFFFAOYSA-N
Molecular Formula	C24H30O6

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