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.

1 – 15 of 217 results

Bambuterol hydrochloride, Thermo Scientific Chemicals

CAS: 81732-46-9 Molecular Formula: C18H30ClN3O5 Molecular Weight (g/mol): 403.90 MDL Number: MFCD03427293 InChI Key: LBARATORRVNNQM-UHFFFAOYNA-N IUPAC Name: hydrogen 3-[2-(tert-butylamino)-1-hydroxyethyl]-5-[(dimethylcarbamoyl)oxy]phenyl N,N-dimethylcarbamate chloride SMILES: [H+].[Cl-].CN(C)C(=O)OC1=CC(=CC(OC(=O)N(C)C)=C1)C(O)CNC(C)(C)C

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Specifications

CAS	81732-46-9
Molecular Weight (g/mol)	403.90
MDL Number	MFCD03427293
SMILES	[H+].[Cl-].CN(C)C(=O)OC1=CC(=CC(OC(=O)N(C)C)=C1)C(O)CNC(C)(C)C
IUPAC Name	hydrogen 3-[2-(tert-butylamino)-1-hydroxyethyl]-5-[(dimethylcarbamoyl)oxy]phenyl N,N-dimethylcarbamate chloride
InChI Key	LBARATORRVNNQM-UHFFFAOYNA-N
Molecular Formula	C18H30ClN3O5

2,6-Dimethoxybenzonitrile, 97%, Thermo Scientific™

CAS: 16932-49-3 Molecular Formula: C₉H₉NO₂ Molecular Weight (g/mol): 163.18 MDL Number: MFCD00001788 InChI Key: XHAHKSSLDJIEDH-UHFFFAOYSA-N Synonym: benzonitrile, 2,6-dimethoxy,2,6-dimethoxy-benzonitrile,2,6-dimethoxybenzenecarbonitrile,pubchem4772,2.6-dimethoxybenzonitrile,benzonitrile,2,6-dimethoxy,2-10-00-00260 beilstein handbook reference,2,6-dimethoxybenzonitrile PubChem CID: 85648 IUPAC Name: 2,6-dimethoxybenzonitrile SMILES: COC1=C(C(=CC=C1)OC)C#N

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PubChem CID	85648
CAS	16932-49-3
Molecular Weight (g/mol)	163.18
MDL Number	MFCD00001788
SMILES	COC1=C(C(=CC=C1)OC)C#N
Synonym	benzonitrile, 2,6-dimethoxy,2,6-dimethoxy-benzonitrile,2,6-dimethoxybenzenecarbonitrile,pubchem4772,2.6-dimethoxybenzonitrile,benzonitrile,2,6-dimethoxy,2-10-00-00260 beilstein handbook reference,2,6-dimethoxybenzonitrile
IUPAC Name	2,6-dimethoxybenzonitrile
InChI Key	XHAHKSSLDJIEDH-UHFFFAOYSA-N
Molecular Formula	C₉H₉NO₂

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

4-(Trifluoromethoxy)toluene, 98%, Thermo Scientific Chemicals

CAS: 706-27-4 Molecular Formula: C8H7F3O Molecular Weight (g/mol): 176.138 MDL Number: MFCD00042413 InChI Key: JUXFXYQUXNXVAA-UHFFFAOYSA-N Synonym: 1-methyl-4-trifluoromethoxy benzene,4-trifluoromethoxytoluene,4-trifluoromethoxy toluene,4-toluene trifluoromethyl ether,4-methyltrifluoromethoxybenzene,benzene, 1-methyl-4-trifluoromethoxy,4-methyl-alpha,alpha,alpha-trifluoroanisole,pubchem13486,acmc-209ofc PubChem CID: 2760631 IUPAC Name: 1-methyl-4-(trifluoromethoxy)benzene SMILES: CC1=CC=C(C=C1)OC(F)(F)F

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Specifications

PubChem CID	2760631
CAS	706-27-4
Molecular Weight (g/mol)	176.138
MDL Number	MFCD00042413
SMILES	CC1=CC=C(C=C1)OC(F)(F)F
Synonym	1-methyl-4-trifluoromethoxy benzene,4-trifluoromethoxytoluene,4-trifluoromethoxy toluene,4-toluene trifluoromethyl ether,4-methyltrifluoromethoxybenzene,benzene, 1-methyl-4-trifluoromethoxy,4-methyl-alpha,alpha,alpha-trifluoroanisole,pubchem13486,acmc-209ofc
IUPAC Name	1-methyl-4-(trifluoromethoxy)benzene
InChI Key	JUXFXYQUXNXVAA-UHFFFAOYSA-N
Molecular Formula	C8H7F3O

3-Ethoxybenzoic acid, 98+%, Thermo Scientific Chemicals

CAS: 621-51-2 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00016517 InChI Key: DTFQMPQJMDEWKJ-UHFFFAOYSA-N Synonym: 3-ethoxybenzoate,m-ethoxybenzoic acid,benzoic acid, 3-ethoxy,3-ethoxy-benzoic acid,benzoic acid, m-ethoxy,3-ethoxybenzoicacid,3-ethyloxy benzoic acid,3-ethoxybenzoic acid PubChem CID: 12126 ChEBI: CHEBI:27990 IUPAC Name: 3-ethoxybenzoic acid SMILES: CCOC1=CC=CC(=C1)C(=O)O

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Specifications

PubChem CID	12126
CAS	621-51-2
Molecular Weight (g/mol)	166.176
ChEBI	CHEBI:27990
MDL Number	MFCD00016517
SMILES	CCOC1=CC=CC(=C1)C(=O)O
Synonym	3-ethoxybenzoate,m-ethoxybenzoic acid,benzoic acid, 3-ethoxy,3-ethoxy-benzoic acid,benzoic acid, m-ethoxy,3-ethoxybenzoicacid,3-ethyloxy benzoic acid,3-ethoxybenzoic acid
IUPAC Name	3-ethoxybenzoic acid
InChI Key	DTFQMPQJMDEWKJ-UHFFFAOYSA-N
Molecular Formula	C9H10O3

2-(Trifluoromethoxy)aniline, 97%, Thermo Scientific™

CAS: 1535-75-7 Molecular Formula: C7H6F3NO Molecular Weight (g/mol): 177.126 MDL Number: MFCD00035959 InChI Key: ZFCOUBUSGHLCDT-UHFFFAOYSA-N Synonym: 2-trifluoromethoxy aniline,benzenamine, 2-trifluoromethoxy,2-trifluoromethoxy-phenylamine,o-trifluoromethoxy aniline,alpha,alpha,alpha-trifluoro-o-anisidine,o-trifluoromethoxyaniline,2-trifluoromethoxy aminobenzene,2-trifluoromethoxy phenylamine,2-trifluoromethoxy phenyl amine PubChem CID: 73754 IUPAC Name: 2-(trifluoromethoxy)aniline SMILES: C1=CC=C(C(=C1)N)OC(F)(F)F

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Specifications

PubChem CID	73754
CAS	1535-75-7
Molecular Weight (g/mol)	177.126
MDL Number	MFCD00035959
SMILES	C1=CC=C(C(=C1)N)OC(F)(F)F
Synonym	2-trifluoromethoxy aniline,benzenamine, 2-trifluoromethoxy,2-trifluoromethoxy-phenylamine,o-trifluoromethoxy aniline,alpha,alpha,alpha-trifluoro-o-anisidine,o-trifluoromethoxyaniline,2-trifluoromethoxy aminobenzene,2-trifluoromethoxy phenylamine,2-trifluoromethoxy phenyl amine
IUPAC Name	2-(trifluoromethoxy)aniline
InChI Key	ZFCOUBUSGHLCDT-UHFFFAOYSA-N
Molecular Formula	C7H6F3NO

4-n-Butoxybenzonitrile, 97%, Thermo Scientific™

CAS: 5203-14-5 Molecular Formula: C11H13NO Molecular Weight (g/mol): 175.231 MDL Number: MFCD00043482 InChI Key: RRGQINKVTNAIBB-UHFFFAOYSA-N Synonym: p-butoxybenzonitrile,4-n-butoxybenzonitrile,benzonitrile, 4-butoxy,4-n-butoxy benzonitrile,4-butoxy-benzonitrile,4-butoxybenzenecarbonitrile,pubchem7926,acmc-209kxf,4-butoxybenzonitrile PubChem CID: 138435 IUPAC Name: 4-butoxybenzonitrile SMILES: CCCCOC1=CC=C(C=C1)C#N

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Specifications

PubChem CID	138435
CAS	5203-14-5
Molecular Weight (g/mol)	175.231
MDL Number	MFCD00043482
SMILES	CCCCOC1=CC=C(C=C1)C#N
Synonym	p-butoxybenzonitrile,4-n-butoxybenzonitrile,benzonitrile, 4-butoxy,4-n-butoxy benzonitrile,4-butoxy-benzonitrile,4-butoxybenzenecarbonitrile,pubchem7926,acmc-209kxf,4-butoxybenzonitrile
IUPAC Name	4-butoxybenzonitrile
InChI Key	RRGQINKVTNAIBB-UHFFFAOYSA-N
Molecular Formula	C11H13NO

4-Propoxybenzonitrile, 97%, Thermo Scientific™

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4-(Phenoxymethyl)benzoic acid, 97%, Thermo Scientific™

CAS: 31719-76-3 Molecular Formula: C14H11O3 Molecular Weight (g/mol): 227.24 MDL Number: MFCD00623268 InChI Key: GRBUVHSYBRTCIB-UHFFFAOYSA-M Synonym: 4-phenoxymethyl benzoic acid,4-phenoxymethyl benzenecarboxylic acid,4-phenoxymethyl-benzoic acid,phenoxymethylbenzenecarboxylicacid PubChem CID: 737267 IUPAC Name: 4-(phenoxymethyl)benzoic acid SMILES: [O-]C(=O)C1=CC=C(COC2=CC=CC=C2)C=C1

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Specifications

PubChem CID	737267
CAS	31719-76-3
Molecular Weight (g/mol)	227.24
MDL Number	MFCD00623268
SMILES	[O-]C(=O)C1=CC=C(COC2=CC=CC=C2)C=C1
Synonym	4-phenoxymethyl benzoic acid,4-phenoxymethyl benzenecarboxylic acid,4-phenoxymethyl-benzoic acid,phenoxymethylbenzenecarboxylicacid
IUPAC Name	4-(phenoxymethyl)benzoic acid
InChI Key	GRBUVHSYBRTCIB-UHFFFAOYSA-M
Molecular Formula	C14H11O3

3-(Phenoxymethyl)benzoic acid, 97%, Thermo Scientific™

CAS: 31719-75-2 Molecular Formula: C14H12O3 Molecular Weight (g/mol): 228.247 InChI Key: URLYREZIPSJJQU-UHFFFAOYSA-N Synonym: 3-phenoxymethyl benzoic acid,benzoic acid,3-phenoxymethyl,4rg PubChem CID: 3729884 IUPAC Name: 3-(phenoxymethyl)benzoic acid SMILES: C1=CC=C(C=C1)OCC2=CC=CC(=C2)C(=O)O

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Specifications

PubChem CID	3729884
CAS	31719-75-2
Molecular Weight (g/mol)	228.247
SMILES	C1=CC=C(C=C1)OCC2=CC=CC(=C2)C(=O)O
Synonym	3-phenoxymethyl benzoic acid,benzoic acid,3-phenoxymethyl,4rg
IUPAC Name	3-(phenoxymethyl)benzoic acid
InChI Key	URLYREZIPSJJQU-UHFFFAOYSA-N
Molecular Formula	C14H12O3

2-(3-Methylphenoxy)ethanol, 98%, Thermo Scientific Chemicals

CAS: 13605-19-1 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.193 MDL Number: MFCD00014035 InChI Key: FDBXUXVQIOQYIX-UHFFFAOYSA-N Synonym: 2-3-methylphenoxy ethanol,2-m-tolyloxy ethanol,ethanol, 2-3-methylphenoxy,ethylene glycol mono-m-tolyl ether,m-cresoxyethanol,2-3-tolyloxy ethanol,ethanol, 2-m-tolyloxy,2-3'-methylphenoxy ethanol,ethylene glycol m-cresyl ether,2-3-methylphenoxy ethan-1-ol PubChem CID: 83611 IUPAC Name: 2-(3-methylphenoxy)ethanol SMILES: CC1=CC(=CC=C1)OCCO

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Specifications

PubChem CID	83611
CAS	13605-19-1
Molecular Weight (g/mol)	152.193
MDL Number	MFCD00014035
SMILES	CC1=CC(=CC=C1)OCCO
Synonym	2-3-methylphenoxy ethanol,2-m-tolyloxy ethanol,ethanol, 2-3-methylphenoxy,ethylene glycol mono-m-tolyl ether,m-cresoxyethanol,2-3-tolyloxy ethanol,ethanol, 2-m-tolyloxy,2-3'-methylphenoxy ethanol,ethylene glycol m-cresyl ether,2-3-methylphenoxy ethan-1-ol
IUPAC Name	2-(3-methylphenoxy)ethanol
InChI Key	FDBXUXVQIOQYIX-UHFFFAOYSA-N
Molecular Formula	C9H12O2

2,4,6-Triphenoxy-1,3,5-triazine, 96%, Thermo Scientific Chemicals

CAS: 1919-48-8 Molecular Formula: C21H15N3O3 Molecular Weight (g/mol): 357.37 MDL Number: MFCD00006048 InChI Key: IYDYVVVAQKFGBS-UHFFFAOYSA-N PubChem CID: 15973 IUPAC Name: 2,4,6-triphenoxy-1,3,5-triazine SMILES: O(C1=CC=CC=C1)C1=NC(OC2=CC=CC=C2)=NC(OC2=CC=CC=C2)=N1

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Specifications

PubChem CID	15973
CAS	1919-48-8
Molecular Weight (g/mol)	357.37
MDL Number	MFCD00006048
SMILES	O(C1=CC=CC=C1)C1=NC(OC2=CC=CC=C2)=NC(OC2=CC=CC=C2)=N1
IUPAC Name	2,4,6-triphenoxy-1,3,5-triazine
InChI Key	IYDYVVVAQKFGBS-UHFFFAOYSA-N
Molecular Formula	C21H15N3O3

2,6-Dichloro-4-(trifluoromethoxy)aniline, 96%, Thermo Scientific™

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

3,4-Diethoxybenzoic acid, 99%, Thermo Scientific™

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3-(Pyridin-2-yloxy)aniline, 97%, Thermo Scientific™

CAS: 86556-09-4 Molecular Formula: C11H10N2O Molecular Weight (g/mol): 186.21 MDL Number: MFCD06825506 InChI Key: CLQMOPKXIBQKKG-UHFFFAOYSA-N Synonym: 3-pyridin-2-yloxy aniline,3-pyridin-2-yloxy-phenylamine,3-2-pyridyloxy aniline,3-2-pyridyloxy phenylamine,3-pyridin-2-yl oxy aniline,benzenamine,3-2-pyridinyloxy,benzenamine, 3-2-pyridinyloxy PubChem CID: 13150573 IUPAC Name: 3-pyridin-2-yloxyaniline SMILES: NC1=CC(OC2=CC=CC=N2)=CC=C1

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Specifications

PubChem CID	13150573
CAS	86556-09-4
Molecular Weight (g/mol)	186.21
MDL Number	MFCD06825506
SMILES	NC1=CC(OC2=CC=CC=N2)=CC=C1
Synonym	3-pyridin-2-yloxy aniline,3-pyridin-2-yloxy-phenylamine,3-2-pyridyloxy aniline,3-2-pyridyloxy phenylamine,3-pyridin-2-yl oxy aniline,benzenamine,3-2-pyridinyloxy,benzenamine, 3-2-pyridinyloxy
IUPAC Name	3-pyridin-2-yloxyaniline
InChI Key	CLQMOPKXIBQKKG-UHFFFAOYSA-N
Molecular Formula	C11H10N2O

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