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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Veratrole, 99%

CAS: 91-16-7 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.166 MDL Number: MFCD00008357 InChI Key: ABDKAPXRBAPSQN-UHFFFAOYSA-N Synonym: veratrole,veratrol,pyrocatechol dimethyl ether,o-dimethoxybenzene,catechol dimethyl ether,benzene, 1,2-dimethoxy,2-methoxyanisole,o,o-dimethyl catechol,2-dimethoxybenzol,benzene, o-dimethoxy PubChem CID: 7043 ChEBI: CHEBI:59114 IUPAC Name: 1,2-dimethoxybenzene SMILES: COC1=CC=CC=C1OC

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PubChem CID	7043
CAS	91-16-7
Molecular Weight (g/mol)	138.166
ChEBI	CHEBI:59114
MDL Number	MFCD00008357
SMILES	COC1=CC=CC=C1OC
Synonym	veratrole,veratrol,pyrocatechol dimethyl ether,o-dimethoxybenzene,catechol dimethyl ether,benzene, 1,2-dimethoxy,2-methoxyanisole,o,o-dimethyl catechol,2-dimethoxybenzol,benzene, o-dimethoxy
IUPAC Name	1,2-dimethoxybenzene
InChI Key	ABDKAPXRBAPSQN-UHFFFAOYSA-N
Molecular Formula	C8H10O2

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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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2,5-Dimethoxybenzonitrile, 98%

CAS: 5312-97-0 Molecular Formula: C9H9NO2 Molecular Weight (g/mol): 163.176 MDL Number: MFCD00016375 InChI Key: HWAMEJIMXIXLIH-UHFFFAOYSA-N PubChem CID: 79200 IUPAC Name: 2,5-dimethoxybenzonitrile SMILES: COC1=CC(=C(C=C1)OC)C#N

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PubChem CID	79200
CAS	5312-97-0
Molecular Weight (g/mol)	163.176
MDL Number	MFCD00016375
SMILES	COC1=CC(=C(C=C1)OC)C#N
IUPAC Name	2,5-dimethoxybenzonitrile
InChI Key	HWAMEJIMXIXLIH-UHFFFAOYSA-N
Molecular Formula	C9H9NO2

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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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Phenyl chloroformate, 99%

CAS: 1885-14-9 Molecular Formula: C7H5ClO2 Molecular Weight (g/mol): 156.57 MDL Number: MFCD00000637 InChI Key: AHWALFGBDFAJAI-UHFFFAOYSA-N Synonym: phenyl chloroformate,chloroformic acid phenyl ester,phenyl chlorocarbonate,carbonochloridic acid, phenyl ester,phenoxycarbonyl chloride,formic acid, chloro-, phenyl ester,fenylester kyseliny chlormravenci,phenylchloroformate,unii-6tnd0d6d3y,6tnd0d6d3y PubChem CID: 15891 IUPAC Name: phenyl carbonochloridate SMILES: ClC(=O)OC1=CC=CC=C1

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PubChem CID	15891
CAS	1885-14-9
Molecular Weight (g/mol)	156.57
MDL Number	MFCD00000637
SMILES	ClC(=O)OC1=CC=CC=C1
Synonym	phenyl chloroformate,chloroformic acid phenyl ester,phenyl chlorocarbonate,carbonochloridic acid, phenyl ester,phenoxycarbonyl chloride,formic acid, chloro-, phenyl ester,fenylester kyseliny chlormravenci,phenylchloroformate,unii-6tnd0d6d3y,6tnd0d6d3y
IUPAC Name	phenyl carbonochloridate
InChI Key	AHWALFGBDFAJAI-UHFFFAOYSA-N
Molecular Formula	C7H5ClO2

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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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Methyl phenyl carbonate, 97%

CAS: 13509-27-8 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD04039782 InChI Key: XTBFPVLHGVYOQH-UHFFFAOYSA-N Synonym: carbonic acid, methyl phenyl ester,phenyl methyl carbonate,phenyl methoxyformate,acmc-20akf2,carbonic acid methyl phenyl PubChem CID: 139482 IUPAC Name: methyl phenyl carbonate SMILES: COC(=O)OC1=CC=CC=C1

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PubChem CID	139482
CAS	13509-27-8
Molecular Weight (g/mol)	152.15
MDL Number	MFCD04039782
SMILES	COC(=O)OC1=CC=CC=C1
Synonym	carbonic acid, methyl phenyl ester,phenyl methyl carbonate,phenyl methoxyformate,acmc-20akf2,carbonic acid methyl phenyl
IUPAC Name	methyl phenyl carbonate
InChI Key	XTBFPVLHGVYOQH-UHFFFAOYSA-N
Molecular Formula	C8H8O3

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4-n-Nonyloxyaniline, 98%

CAS: 50262-67-4 Molecular Formula: C15H25NO Molecular Weight (g/mol): 235.371 MDL Number: MFCD00043622 InChI Key: JQLBBFVOAHUASD-UHFFFAOYSA-N Synonym: p-nonyloxyaniline,4-n-nonyloxyaniline,4-nonyloxyaniline,4-nonyloxy aniline,4-nonyloxyphenylamine,4-nonyloxy aniline #,benzenamine,4-nonyloxy PubChem CID: 142698 IUPAC Name: 4-nonoxyaniline SMILES: CCCCCCCCCOC1=CC=C(C=C1)N

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PubChem CID	142698
CAS	50262-67-4
Molecular Weight (g/mol)	235.371
MDL Number	MFCD00043622
SMILES	CCCCCCCCCOC1=CC=C(C=C1)N
Synonym	p-nonyloxyaniline,4-n-nonyloxyaniline,4-nonyloxyaniline,4-nonyloxy aniline,4-nonyloxyphenylamine,4-nonyloxy aniline #,benzenamine,4-nonyloxy
IUPAC Name	4-nonoxyaniline
InChI Key	JQLBBFVOAHUASD-UHFFFAOYSA-N
Molecular Formula	C15H25NO

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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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Phenyl methanesulfonate, 98%

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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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

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Triphenyl borate, 97%

CAS: 1095-03-0 Molecular Formula: C18H15BO3 Molecular Weight (g/mol): 290.125 MDL Number: MFCD00059011 InChI Key: MDCWDBMBZLORER-UHFFFAOYSA-N Synonym: triphenoxyborane,phenyl borate,triphenoxyboron,boric acid, triphenyl ester,phenyl borate, pho 3 b,trifenylester kyseliny borite,boric acid h3bo3 , triphenyl ester,triphenyl ester boric acid,trifenylester kyseliny borite czech,boric acid triphenyl ester PubChem CID: 14182 IUPAC Name: triphenyl borate SMILES: B(OC1=CC=CC=C1)(OC2=CC=CC=C2)OC3=CC=CC=C3

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PubChem CID	14182
CAS	1095-03-0
Molecular Weight (g/mol)	290.125
MDL Number	MFCD00059011
SMILES	B(OC1=CC=CC=C1)(OC2=CC=CC=C2)OC3=CC=CC=C3
Synonym	triphenoxyborane,phenyl borate,triphenoxyboron,boric acid, triphenyl ester,phenyl borate, pho 3 b,trifenylester kyseliny borite,boric acid h3bo3 , triphenyl ester,triphenyl ester boric acid,trifenylester kyseliny borite czech,boric acid triphenyl ester
IUPAC Name	triphenyl borate
InChI Key	MDCWDBMBZLORER-UHFFFAOYSA-N
Molecular Formula	C18H15BO3

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1,3-Dimethoxybenzene, 99%

CAS: 151-10-0 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.17 MDL Number: MFCD00008384 InChI Key: DPZNOMCNRMUKPS-UHFFFAOYSA-N Synonym: m-dimethoxybenzene,resorcinol dimethyl ether,benzene, 1,3-dimethoxy,3-methoxyanisole,benzene, m-dimethoxy,dimethyl resorcinol,m-methoxyanisole,dimethylresorcinol,methoxyanisole, m,dimethylether resorcinolu PubChem CID: 9025 IUPAC Name: 1,3-dimethoxybenzene SMILES: COC1=CC(OC)=CC=C1

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PubChem CID	9025
CAS	151-10-0
Molecular Weight (g/mol)	138.17
MDL Number	MFCD00008384
SMILES	COC1=CC(OC)=CC=C1
Synonym	m-dimethoxybenzene,resorcinol dimethyl ether,benzene, 1,3-dimethoxy,3-methoxyanisole,benzene, m-dimethoxy,dimethyl resorcinol,m-methoxyanisole,dimethylresorcinol,methoxyanisole, m,dimethylether resorcinolu
IUPAC Name	1,3-dimethoxybenzene
InChI Key	DPZNOMCNRMUKPS-UHFFFAOYSA-N
Molecular Formula	C8H10O2

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2-Phenoxyethanol, 99%

CAS: 122-99-6 Molecular Formula: C₈H₁₀O₂ Molecular Weight (g/mol): 138.17 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)	138.17
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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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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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

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4-n-Propoxyaniline, 97%

CAS: 4469-80-1 Molecular Formula: C9H13NO Molecular Weight (g/mol): 151.21 MDL Number: MFCD00043621 InChI Key: DWOIGSLSPPLRKO-UHFFFAOYSA-N Synonym: p-propoxyaniline,benzenamine, 4-propoxy,4-n-propoxyaniline,4-propoxyphenyl amine hydrochloride,4-propoxyphenylamine,hydrochloride,4-propyloxyaniline,4-propoxybenzenamine,4-propoxy-phenylamine PubChem CID: 78221 IUPAC Name: 4-propoxyaniline SMILES: CCCOC1=CC=C(N)C=C1

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PubChem CID	78221
CAS	4469-80-1
Molecular Weight (g/mol)	151.21
MDL Number	MFCD00043621
SMILES	CCCOC1=CC=C(N)C=C1
Synonym	p-propoxyaniline,benzenamine, 4-propoxy,4-n-propoxyaniline,4-propoxyphenyl amine hydrochloride,4-propoxyphenylamine,hydrochloride,4-propyloxyaniline,4-propoxybenzenamine,4-propoxy-phenylamine
IUPAC Name	4-propoxyaniline
InChI Key	DWOIGSLSPPLRKO-UHFFFAOYSA-N
Molecular Formula	C9H13NO

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