Phenoxy compounds

Organic compounds that have one or more phenyl groups that are bonded to an oxygen with a radical electron; includes compounds with additional substitutions.

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1,4-Dimethoxybenzene, 98%

CAS: 150-78-7 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.17 MDL Number: MFCD00008401 InChI Key: OHBQPCCCRFSCAX-UHFFFAOYSA-N Synonym: p-dimethoxybenzene,p-methoxyanisole,hydroquinone dimethyl ether,benzene, 1,4-dimethoxy,quinol dimethyl ether,benzene, p-dimethoxy,dimethylhydroquinone ether,dimethyl ether hydroquinone,1,4-dimethoxybenzol,usaf an-9 PubChem CID: 9016 IUPAC Name: 1,4-dimethoxybenzene SMILES: COC1=CC=C(OC)C=C1

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PubChem CID	9016
CAS	150-78-7
Molecular Weight (g/mol)	138.17
MDL Number	MFCD00008401
SMILES	COC1=CC=C(OC)C=C1
Synonym	p-dimethoxybenzene,p-methoxyanisole,hydroquinone dimethyl ether,benzene, 1,4-dimethoxy,quinol dimethyl ether,benzene, p-dimethoxy,dimethylhydroquinone ether,dimethyl ether hydroquinone,1,4-dimethoxybenzol,usaf an-9
IUPAC Name	1,4-dimethoxybenzene
InChI Key	OHBQPCCCRFSCAX-UHFFFAOYSA-N
Molecular Formula	C8H10O2

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tert-Butyl phenyl carbonate, 97%

CAS: 6627-89-0 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00008804 InChI Key: UXWVQHXKKOGTSY-UHFFFAOYSA-N Synonym: t-butyl phenyl carbonate,tert-butylphenylcarbonate,2-methyl-2-propanyl phenyl carbonate,carbonic acid, 1,1-dimethylethyl phenyl ester,pubchem13300,acmc-209nuo,phenyl t-butyl carbonate,uxwvqhxkkogtsy-uhfffaoysa,tert-butyl phenyl carbonate,carbonic acid tert-butylphenyl ester PubChem CID: 81113 IUPAC Name: tert-butyl phenyl carbonate SMILES: CC(C)(C)OC(=O)OC1=CC=CC=C1

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PubChem CID	81113
CAS	6627-89-0
Molecular Weight (g/mol)	194.23
MDL Number	MFCD00008804
SMILES	CC(C)(C)OC(=O)OC1=CC=CC=C1
Synonym	t-butyl phenyl carbonate,tert-butylphenylcarbonate,2-methyl-2-propanyl phenyl carbonate,carbonic acid, 1,1-dimethylethyl phenyl ester,pubchem13300,acmc-209nuo,phenyl t-butyl carbonate,uxwvqhxkkogtsy-uhfffaoysa,tert-butyl phenyl carbonate,carbonic acid tert-butylphenyl ester
IUPAC Name	tert-butyl phenyl carbonate
InChI Key	UXWVQHXKKOGTSY-UHFFFAOYSA-N
Molecular Formula	C11H14O3

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Diphenyl N-cyanocarbonimidate, 97%

CAS: 79463-77-7 Molecular Formula: C14H10N2O2 Molecular Weight (g/mol): 238.25 MDL Number: MFCD00010380 InChI Key: SLIKWVTWIGHFJE-UHFFFAOYSA-N Synonym: diphenyl n-cyanocarbonimidate,diphenyl cyanocarbonimidate,diphenoxymethylenecyanamide,n-cyano-diphenyl imidocarbonate,diphenylcyanocarbonimidate,cyanocarbonimidia acid diphenyl aester,n-cyanocarbonimidic acid diphenyl ester,bis phenoxy methylidenecyanamide,cyano diphenoxymethylidene amine,3,3-diphenoxy-2-azaprop-2-enenitrile PubChem CID: 688090 SMILES: N#CN=C(OC1=CC=CC=C1)OC1=CC=CC=C1

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PubChem CID	688090
CAS	79463-77-7
Molecular Weight (g/mol)	238.25
MDL Number	MFCD00010380
SMILES	N#CN=C(OC1=CC=CC=C1)OC1=CC=CC=C1
Synonym	diphenyl n-cyanocarbonimidate,diphenyl cyanocarbonimidate,diphenoxymethylenecyanamide,n-cyano-diphenyl imidocarbonate,diphenylcyanocarbonimidate,cyanocarbonimidia acid diphenyl aester,n-cyanocarbonimidic acid diphenyl ester,bis phenoxy methylidenecyanamide,cyano diphenoxymethylidene amine,3,3-diphenoxy-2-azaprop-2-enenitrile
InChI Key	SLIKWVTWIGHFJE-UHFFFAOYSA-N
Molecular Formula	C14H10N2O2

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4-Allyl-2,6-dimethoxyphenol, 98%

CAS: 6627-88-9 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00008655 InChI Key: FWMPKHMKIJDEMJ-UHFFFAOYSA-N Synonym: 4-allyl-2,6-dimethoxyphenol,methoxyeugenol,4-allylsyringol,phenol, 2,6-dimethoxy-4-2-propenyl,2,6-dimethoxychavicol,phenol, 4-allyl-2,6-dimethoxy,unii-8vf00ywp89,2,6-dimethoxy-4-allylphenol,2,6-dimethoxy-4-prop-2-en-1-yl phenol,4-hydroxy-3,5-dimethoxyallylbenzene PubChem CID: 226486 ChEBI: CHEBI:86562 IUPAC Name: 2,6-dimethoxy-4-prop-2-enylphenol SMILES: COC1=CC(CC=C)=CC(OC)=C1O

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PubChem CID	226486
CAS	6627-88-9
Molecular Weight (g/mol)	194.23
ChEBI	CHEBI:86562
MDL Number	MFCD00008655
SMILES	COC1=CC(CC=C)=CC(OC)=C1O
Synonym	4-allyl-2,6-dimethoxyphenol,methoxyeugenol,4-allylsyringol,phenol, 2,6-dimethoxy-4-2-propenyl,2,6-dimethoxychavicol,phenol, 4-allyl-2,6-dimethoxy,unii-8vf00ywp89,2,6-dimethoxy-4-allylphenol,2,6-dimethoxy-4-prop-2-en-1-yl phenol,4-hydroxy-3,5-dimethoxyallylbenzene
IUPAC Name	2,6-dimethoxy-4-prop-2-enylphenol
InChI Key	FWMPKHMKIJDEMJ-UHFFFAOYSA-N
Molecular Formula	C11H14O3

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4'-n-Octyloxybiphenyl-4-carboxylic acid, 99%

CAS: 59748-18-4 Molecular Formula: C21H26O3 Molecular Weight (g/mol): 326.44 MDL Number: MFCD00192369 InChI Key: YNBBQLUKHHSKPW-UHFFFAOYSA-N Synonym: 4'-octyloxy-1,1'-biphenyl-4-carboxylic acid,4'-octyloxy-4-biphenylcarboxylic acid,4-n-octyloxybiphenyl-4'-carboxylic acid,4'-octyloxy biphenyl-4-carboxylic acid,4-4-octyloxyphenyl benzoic acid,4-4-octoxyphenyl benzoic acid,4-4-octyloxy phenyl benzoic acid,4-octyloxybiphenyl-4'carboxylic acid PubChem CID: 2802556 IUPAC Name: 4-(4-octoxyphenyl)benzoic acid SMILES: CCCCCCCCOC1=CC=C(C=C1)C1=CC=C(C=C1)C(O)=O

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PubChem CID	2802556
CAS	59748-18-4
Molecular Weight (g/mol)	326.44
MDL Number	MFCD00192369
SMILES	CCCCCCCCOC1=CC=C(C=C1)C1=CC=C(C=C1)C(O)=O
Synonym	4'-octyloxy-1,1'-biphenyl-4-carboxylic acid,4'-octyloxy-4-biphenylcarboxylic acid,4-n-octyloxybiphenyl-4'-carboxylic acid,4'-octyloxy biphenyl-4-carboxylic acid,4-4-octyloxyphenyl benzoic acid,4-4-octoxyphenyl benzoic acid,4-4-octyloxy phenyl benzoic acid,4-octyloxybiphenyl-4'carboxylic acid
IUPAC Name	4-(4-octoxyphenyl)benzoic acid
InChI Key	YNBBQLUKHHSKPW-UHFFFAOYSA-N
Molecular Formula	C21H26O3

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2,4-Dimethoxybenzonitrile, 99%

CAS: 4107-65-7 Molecular Formula: C9H9NO2 Molecular Weight (g/mol): 163.176 MDL Number: MFCD00001786 InChI Key: RYRZSQQELLQCMZ-UHFFFAOYSA-N Synonym: benzonitrile, 2,4-dimethoxy,2,4-dimethoxy-benzonitrile,2,4-dimethoxybenzenecarbonitrile,pubchem13105,acmc-1anqc,2.4-dimethoxybenzonitril,ksc497m9f,2,4-dimethoxybenzonitrile PubChem CID: 77750 IUPAC Name: 2,4-dimethoxybenzonitrile SMILES: COC1=CC(=C(C=C1)C#N)OC

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Specifications

PubChem CID	77750
CAS	4107-65-7
Molecular Weight (g/mol)	163.176
MDL Number	MFCD00001786
SMILES	COC1=CC(=C(C=C1)C#N)OC
Synonym	benzonitrile, 2,4-dimethoxy,2,4-dimethoxy-benzonitrile,2,4-dimethoxybenzenecarbonitrile,pubchem13105,acmc-1anqc,2.4-dimethoxybenzonitril,ksc497m9f,2,4-dimethoxybenzonitrile
IUPAC Name	2,4-dimethoxybenzonitrile
InChI Key	RYRZSQQELLQCMZ-UHFFFAOYSA-N
Molecular Formula	C9H9NO2

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Methyl pentafluorophenyl carbonate, 97%, Thermo Scientific Chemicals

CAS: 36919-03-6 Molecular Formula: C8H3F5O3 Molecular Weight (g/mol): 242.10 MDL Number: MFCD01075723 InChI Key: HGYOVHMDBHQLOE-UHFFFAOYSA-N Synonym: methyl pentafluorophenyl carbonate,carbonic acid, methyl pentafluorophenyl ester,acmc-20akf4,pentafluorophenoxy methoxy ketone,methyl perfluorophenyl carbonate,carbonic acid methyl pentafluorophenyl ester PubChem CID: 14189360 SMILES: COC(=O)OC1=C(F)C(F)=C(F)C(F)=C1F

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PubChem CID	14189360
CAS	36919-03-6
Molecular Weight (g/mol)	242.10
MDL Number	MFCD01075723
SMILES	COC(=O)OC1=C(F)C(F)=C(F)C(F)=C1F
Synonym	methyl pentafluorophenyl carbonate,carbonic acid, methyl pentafluorophenyl ester,acmc-20akf4,pentafluorophenoxy methoxy ketone,methyl perfluorophenyl carbonate,carbonic acid methyl pentafluorophenyl ester
InChI Key	HGYOVHMDBHQLOE-UHFFFAOYSA-N
Molecular Formula	C8H3F5O3

2,6-Dimethoxybenzoic acid, 99%

CAS: 1466-76-8 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.18 MDL Number: MFCD00002437 InChI Key: MBIZFBDREVRUHY-UHFFFAOYSA-N Synonym: benzoic acid, 2,6-dimethoxy,2,6-dimethoxy-benzoic acid,unii-g6b3p1lo43,2,6-dimethoxybenzoicacid,pubchem19743,acmc-1bwjj,intermediates-zcf02125,benzoic acid,6-dimethoxy,dsstox_cid_26999,dsstox_rid_82043 PubChem CID: 15109 IUPAC Name: 2,6-dimethoxybenzoic acid SMILES: COC1=CC=CC(OC)=C1C(O)=O

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PubChem CID	15109
CAS	1466-76-8
Molecular Weight (g/mol)	182.18
MDL Number	MFCD00002437
SMILES	COC1=CC=CC(OC)=C1C(O)=O
Synonym	benzoic acid, 2,6-dimethoxy,2,6-dimethoxy-benzoic acid,unii-g6b3p1lo43,2,6-dimethoxybenzoicacid,pubchem19743,acmc-1bwjj,intermediates-zcf02125,benzoic acid,6-dimethoxy,dsstox_cid_26999,dsstox_rid_82043
IUPAC Name	2,6-dimethoxybenzoic acid
InChI Key	MBIZFBDREVRUHY-UHFFFAOYSA-N
Molecular Formula	C9H10O4

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2-Phenoxyethanol, 94%

CAS: 122-99-6 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.166 MDL Number: MFCD00002857 InChI Key: QCDWFXQBSFUVSP-UHFFFAOYSA-N Synonym: phenoxyethanol,ethylene glycol monophenyl ether,phenyl cellosolve,ethanol, 2-phenoxy,phenoxytol,phenoxethol,phenoxetol,ethylene glycol phenyl ether,phenoxyethyl alcohol,1-hydroxy-2-phenoxyethane PubChem CID: 31236 ChEBI: CHEBI:64275 IUPAC Name: 2-phenoxyethanol SMILES: C1=CC=C(C=C1)OCCO

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PubChem CID	31236
CAS	122-99-6
Molecular Weight (g/mol)	138.166
ChEBI	CHEBI:64275
MDL Number	MFCD00002857
SMILES	C1=CC=C(C=C1)OCCO
Synonym	phenoxyethanol,ethylene glycol monophenyl ether,phenyl cellosolve,ethanol, 2-phenoxy,phenoxytol,phenoxethol,phenoxetol,ethylene glycol phenyl ether,phenoxyethyl alcohol,1-hydroxy-2-phenoxyethane
IUPAC Name	2-phenoxyethanol
InChI Key	QCDWFXQBSFUVSP-UHFFFAOYSA-N
Molecular Formula	C8H10O2

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4-Benzyloxybenzoic acid, 98%

CAS: 1486-51-7 Molecular Formula: C14H12O3 Molecular Weight (g/mol): 228.25 MDL Number: MFCD00016527 InChI Key: AQSCHALQLXXKKC-UHFFFAOYSA-N PubChem CID: 73880 IUPAC Name: 4-phenylmethoxybenzoic acid SMILES: OC(=O)C1=CC=C(OCC2=CC=CC=C2)C=C1

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PubChem CID	73880
CAS	1486-51-7
Molecular Weight (g/mol)	228.25
MDL Number	MFCD00016527
SMILES	OC(=O)C1=CC=C(OCC2=CC=CC=C2)C=C1
IUPAC Name	4-phenylmethoxybenzoic acid
InChI Key	AQSCHALQLXXKKC-UHFFFAOYSA-N
Molecular Formula	C14H12O3

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Hydroquinone bis(2-hydroxyethyl)ether, 98+%

CAS: 104-38-1 Molecular Formula: C₁₀H₁₄O₄ Molecular Weight (g/mol): 198.22 MDL Number: MFCD00002861 InChI Key: WTPYFJNYAMXZJG-UHFFFAOYSA-N Synonym: hydroquinone bis 2-hydroxyethyl ether,1,4-bis 2-hydroxyethoxy benzene,vernatzer 30/10,2,2'-1,4-phenylenebis oxy diethanol,hydroquinone di 2-hydroxyethyl ether,hydroquinone diethylol ether,2,2'-phenylenedioxy diethanol,2,2'-p-phenylenedioxy diethanol,2,2'-p-phenylenedioxydiethanol,2-4-2-hydroxyethoxy phenoxy ethanol PubChem CID: 66912 IUPAC Name: 2-[4-(2-hydroxyethoxy)phenoxy]ethanol SMILES: C1=CC(=CC=C1OCCO)OCCO

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PubChem CID	66912
CAS	104-38-1
Molecular Weight (g/mol)	198.22
MDL Number	MFCD00002861
SMILES	C1=CC(=CC=C1OCCO)OCCO
Synonym	hydroquinone bis 2-hydroxyethyl ether,1,4-bis 2-hydroxyethoxy benzene,vernatzer 30/10,2,2'-1,4-phenylenebis oxy diethanol,hydroquinone di 2-hydroxyethyl ether,hydroquinone diethylol ether,2,2'-phenylenedioxy diethanol,2,2'-p-phenylenedioxy diethanol,2,2'-p-phenylenedioxydiethanol,2-4-2-hydroxyethoxy phenoxy ethanol
IUPAC Name	2-[4-(2-hydroxyethoxy)phenoxy]ethanol
InChI Key	WTPYFJNYAMXZJG-UHFFFAOYSA-N
Molecular Formula	C₁₀H₁₄O₄

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(4-Bromophenoxy)-tert-butyldimethylsilane, 97%

CAS: 67963-68-2 Molecular Formula: C₁₂H₁₉BrOSi Molecular Weight (g/mol): 287.27 MDL Number: MFCD00239382 InChI Key: DLGZGLKSNRKLSM-UHFFFAOYSA-N Synonym: 4-bromophenoxy tert-butyl dimethylsilane,4-bromophenoxy-tert-butyldimethylsilane,p-bromophenoxy t-butyl dimethylsilane,4-bromophenoxy-tert-butyl-dimethylsilane,1-bromo-4-tert-butyldimethylsiloxy benzene,4-bromophenol tert-butyldimethylsilyl ether,silane, 4-bromophenoxy 1,1-dimethylethyl dimethyl,1-bromo-4-1,1-dimethylethyl dimethylsilyl oxy benzene,acmc-1b8oo PubChem CID: 4227167 IUPAC Name: (4-bromophenoxy)-tert-butyl-dimethylsilane SMILES: CC(C)(C)[Si](C)(C)OC1=CC=C(C=C1)Br

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PubChem CID	4227167
CAS	67963-68-2
Molecular Weight (g/mol)	287.27
MDL Number	MFCD00239382
SMILES	CC(C)(C)[Si](C)(C)OC1=CC=C(C=C1)Br
Synonym	4-bromophenoxy tert-butyl dimethylsilane,4-bromophenoxy-tert-butyldimethylsilane,p-bromophenoxy t-butyl dimethylsilane,4-bromophenoxy-tert-butyl-dimethylsilane,1-bromo-4-tert-butyldimethylsiloxy benzene,4-bromophenol tert-butyldimethylsilyl ether,silane, 4-bromophenoxy 1,1-dimethylethyl dimethyl,1-bromo-4-1,1-dimethylethyl dimethylsilyl oxy benzene,acmc-1b8oo
IUPAC Name	(4-bromophenoxy)-tert-butyl-dimethylsilane
InChI Key	DLGZGLKSNRKLSM-UHFFFAOYSA-N
Molecular Formula	C₁₂H₁₉BrOSi

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4-Ethoxybenzoic acid, 98+%

CAS: 619-86-3 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00002545 InChI Key: SHSGDXCJYVZFTP-UHFFFAOYSA-N Synonym: p-ethoxybenzoic acid,benzoic acid, 4-ethoxy,benzoic acid, p-ethoxy,4-ethoxy-benzoic acid,unii-tzr23xeq7w,tzr23xeq7w,4-ethoxybenzoicacid,4ethoxybenzoic acid,pubchem2686,para-ethoxybenzoic acid PubChem CID: 12093 IUPAC Name: 4-ethoxybenzoic acid SMILES: CCOC1=CC=C(C=C1)C(=O)O

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PubChem CID	12093
CAS	619-86-3
Molecular Weight (g/mol)	166.176
MDL Number	MFCD00002545
SMILES	CCOC1=CC=C(C=C1)C(=O)O
Synonym	p-ethoxybenzoic acid,benzoic acid, 4-ethoxy,benzoic acid, p-ethoxy,4-ethoxy-benzoic acid,unii-tzr23xeq7w,tzr23xeq7w,4-ethoxybenzoicacid,4ethoxybenzoic acid,pubchem2686,para-ethoxybenzoic acid
IUPAC Name	4-ethoxybenzoic acid
InChI Key	SHSGDXCJYVZFTP-UHFFFAOYSA-N
Molecular Formula	C9H10O3

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PubChem CID	15109
CAS	1466-76-8
Molecular Weight (g/mol)	182.18
MDL Number	MFCD00002437
SMILES	COC1=CC=CC(OC)=C1C(O)=O
Synonym	benzoic acid, 2,6-dimethoxy,2,6-dimethoxy-benzoic acid,unii-g6b3p1lo43,2,6-dimethoxybenzoicacid,pubchem19743,acmc-1bwjj,intermediates-zcf02125,benzoic acid,6-dimethoxy,dsstox_cid_26999,dsstox_rid_82043
IUPAC Name	2,6-dimethoxybenzoic acid
InChI Key	MBIZFBDREVRUHY-UHFFFAOYSA-N
Molecular Formula	C9H10O4

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4-n-Decyloxybenzoic acid, 96%

CAS: 5519-23-3 Molecular Formula: C17H26O3 Molecular Weight (g/mol): 278.392 MDL Number: MFCD00020360 InChI Key: NZNICZRIRMGOFG-UHFFFAOYSA-N PubChem CID: 138527 IUPAC Name: 4-decoxybenzoic acid SMILES: CCCCCCCCCCOC1=CC=C(C=C1)C(=O)O

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Specifications

PubChem CID	138527
CAS	5519-23-3
Molecular Weight (g/mol)	278.392
MDL Number	MFCD00020360
SMILES	CCCCCCCCCCOC1=CC=C(C=C1)C(=O)O
IUPAC Name	4-decoxybenzoic acid
InChI Key	NZNICZRIRMGOFG-UHFFFAOYSA-N
Molecular Formula	C17H26O3

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