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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Ethyl 3-phenoxypropionate, 98%

CAS: 22409-91-2 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00026919 InChI Key: TXKJOPXGYSFUNC-UHFFFAOYSA-N PubChem CID: 347973 IUPAC Name: ethyl 3-phenoxypropanoate SMILES: CCOC(=O)CCOC1=CC=CC=C1

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PubChem CID	347973
CAS	22409-91-2
Molecular Weight (g/mol)	194.23
MDL Number	MFCD00026919
SMILES	CCOC(=O)CCOC1=CC=CC=C1
IUPAC Name	ethyl 3-phenoxypropanoate
InChI Key	TXKJOPXGYSFUNC-UHFFFAOYSA-N
Molecular Formula	C11H14O3

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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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

3-[(6-Methylpyrazin-2-yl)oxy]aniline, 97%, Thermo Scientific™

CAS: 915707-61-8 Molecular Formula: C11H11N3O Molecular Weight (g/mol): 201.229 MDL Number: MFCD09702406 InChI Key: ZFDWDKWQAXTCSU-UHFFFAOYSA-N PubChem CID: 24229682 IUPAC Name: 3-(6-methylpyrazin-2-yl)oxyaniline SMILES: CC1=CN=CC(=N1)OC2=CC=CC(=C2)N

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PubChem CID	24229682
CAS	915707-61-8
Molecular Weight (g/mol)	201.229
MDL Number	MFCD09702406
SMILES	CC1=CN=CC(=N1)OC2=CC=CC(=C2)N
IUPAC Name	3-(6-methylpyrazin-2-yl)oxyaniline
InChI Key	ZFDWDKWQAXTCSU-UHFFFAOYSA-N
Molecular Formula	C11H11N3O

3-[(6-Methylpyrazin-2-yl)oxy]benzoic acid, 97%, Thermo Scientific™

CAS: 906352-96-3 Molecular Formula: C12H10N2O3 Molecular Weight (g/mol): 230.223 MDL Number: MFCD09817520 InChI Key: OKPBLLHANTVVJS-UHFFFAOYSA-N Synonym: 3-6-methylpyrazin-2-yl oxy benzoic acid,benzoicacid, 3-6-methyl-2-pyrazinyl oxy,3-6-methylpyrazin-2-yloxy benzoic acid,benzoicacid,3-6-methyl-2-pyrazinyl oxy PubChem CID: 24229674 IUPAC Name: 3-(6-methylpyrazin-2-yl)oxybenzoic acid SMILES: CC1=CN=CC(=N1)OC2=CC=CC(=C2)C(=O)O

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PubChem CID	24229674
CAS	906352-96-3
Molecular Weight (g/mol)	230.223
MDL Number	MFCD09817520
SMILES	CC1=CN=CC(=N1)OC2=CC=CC(=C2)C(=O)O
Synonym	3-6-methylpyrazin-2-yl oxy benzoic acid,benzoicacid, 3-6-methyl-2-pyrazinyl oxy,3-6-methylpyrazin-2-yloxy benzoic acid,benzoicacid,3-6-methyl-2-pyrazinyl oxy
IUPAC Name	3-(6-methylpyrazin-2-yl)oxybenzoic acid
InChI Key	OKPBLLHANTVVJS-UHFFFAOYSA-N
Molecular Formula	C12H10N2O3

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4-(Difluoromethoxy)aniline, 97%

CAS: 22236-10-8 Molecular Formula: C7H7F2NO Molecular Weight (g/mol): 159.136 MDL Number: MFCD00085005 InChI Key: NDEZTSHWEPQVBX-UHFFFAOYSA-N Synonym: 4-difluoromethoxy aniline,4-difluoromethoxy-phenylamine,p-difluoromethoxyaniline,4-amino-alpha,alpha-difluoroanisole,4-difluoromethoxy benzenamine,benzenamine, 4-difluoromethoxy,4-difluoromethoxy phenylamine,4-difluormethoxy anilin,pubchem8467 PubChem CID: 737363 IUPAC Name: 4-(difluoromethoxy)aniline SMILES: C1=CC(=CC=C1N)OC(F)F

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PubChem CID	737363
CAS	22236-10-8
Molecular Weight (g/mol)	159.136
MDL Number	MFCD00085005
SMILES	C1=CC(=CC=C1N)OC(F)F
Synonym	4-difluoromethoxy aniline,4-difluoromethoxy-phenylamine,p-difluoromethoxyaniline,4-amino-alpha,alpha-difluoroanisole,4-difluoromethoxy benzenamine,benzenamine, 4-difluoromethoxy,4-difluoromethoxy phenylamine,4-difluormethoxy anilin,pubchem8467
IUPAC Name	4-(difluoromethoxy)aniline
InChI Key	NDEZTSHWEPQVBX-UHFFFAOYSA-N
Molecular Formula	C7H7F2NO

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4-Isopropoxybenzoic acid, 99%

CAS: 13205-46-4 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00044318 InChI Key: ZVERWTXKKWSSHH-UHFFFAOYSA-N PubChem CID: 72972 IUPAC Name: 4-propan-2-yloxybenzoic acid SMILES: CC(C)OC1=CC=C(C=C1)C(=O)O

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PubChem CID	72972
CAS	13205-46-4
Molecular Weight (g/mol)	180.203
MDL Number	MFCD00044318
SMILES	CC(C)OC1=CC=C(C=C1)C(=O)O
IUPAC Name	4-propan-2-yloxybenzoic acid
InChI Key	ZVERWTXKKWSSHH-UHFFFAOYSA-N
Molecular Formula	C10H12O3

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Propylene Phenoxytol, Reagent, Spectrum™ Chemical

CAS: 770-35-4 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.19 MDL Number: MFCD00016861 InChI Key: IBLKWZIFZMJLFL-UHFFFAOYNA-N IUPAC Name: 1-phenoxypropan-2-ol SMILES: CC(O)COC1=CC=CC=C1

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CAS	770-35-4
Molecular Weight (g/mol)	152.19
MDL Number	MFCD00016861
SMILES	CC(O)COC1=CC=CC=C1
IUPAC Name	1-phenoxypropan-2-ol
InChI Key	IBLKWZIFZMJLFL-UHFFFAOYNA-N
Molecular Formula	C9H12O2

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Ethyl 5-phenoxycarbonylamino-1,2,3-thiadiazole-4-carboxylate, 98+%

CAS: 2037-81-2 Molecular Formula: C12H11N3O4S Molecular Weight (g/mol): 293.30 MDL Number: MFCD00100230 InChI Key: FCPHNPRVMWSGSK-UHFFFAOYSA-N Synonym: ethyl 5-phenoxycarbonylamino-1,2,3-thiadiazole-4-carboxylate,ethyl 5-phenoxycarbonyl amino-1,2,3-thiadiazole-4-carboxylate,5-n-phenoxycarbonylamino-1,2,3-thiadiazole-4-carboxylic acid ethyl ester,tos-bb-0370,ethyl 5-phenoxycarbonylamino thiadiazole-4-carboxylate,ethyl 5-phenoxycarbonylamino-1,2,3-thiadiazole-4-carboxylate, 98+% PubChem CID: 6917126 IUPAC Name: ethyl 5-(phenoxycarbonylamino)thiadiazole-4-carboxylate SMILES: CCOC(=O)C1=C(NC(=O)OC2=CC=CC=C2)SN=N1

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PubChem CID	6917126
CAS	2037-81-2
Molecular Weight (g/mol)	293.30
MDL Number	MFCD00100230
SMILES	CCOC(=O)C1=C(NC(=O)OC2=CC=CC=C2)SN=N1
Synonym	ethyl 5-phenoxycarbonylamino-1,2,3-thiadiazole-4-carboxylate,ethyl 5-phenoxycarbonyl amino-1,2,3-thiadiazole-4-carboxylate,5-n-phenoxycarbonylamino-1,2,3-thiadiazole-4-carboxylic acid ethyl ester,tos-bb-0370,ethyl 5-phenoxycarbonylamino thiadiazole-4-carboxylate,ethyl 5-phenoxycarbonylamino-1,2,3-thiadiazole-4-carboxylate, 98+%
IUPAC Name	ethyl 5-(phenoxycarbonylamino)thiadiazole-4-carboxylate
InChI Key	FCPHNPRVMWSGSK-UHFFFAOYSA-N
Molecular Formula	C12H11N3O4S

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3-(tert-Butyldimethylsilyloxy)phenylboronic acid, 96+%, Thermo Scientific Chemicals

CAS: 261621-12-9 Molecular Formula: C12H21BO3Si Molecular Weight (g/mol): 252.19 MDL Number: MFCD03701505 InChI Key: RDQWADDNQONTLB-UHFFFAOYSA-N Synonym: 3-tert-butyldimethylsilyl oxy phenyl boronic acid,3-tert-butyldimethylsilyloxy phenylboronic acid,3-t-butyldimethylsilyloxy phenylboronic acid,3-tert-butyl dimethylsiloxy phenyl boronic acid,3-tert-butyldimethylsilyloxy benzeneboronic acid,3-tert-butyldimethylsiloxy benzeneboronic acid,3-tert-butyldimethylsilyl oxy phenylboronic acid,3-tert-butyl dimethyl silyl oxyphenyl boronic acid,m-t-butyldimethylsilyloxy phenylboronic acid,3-t-butyl dimethylsiloxy phenyl boronic acid PubChem CID: 3463029 IUPAC Name: [3-[tert-butyl(dimethyl)silyl]oxyphenyl]boronic acid SMILES: CC(C)(C)[Si](C)(C)OC1=CC=CC(=C1)B(O)O

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PubChem CID	3463029
CAS	261621-12-9
Molecular Weight (g/mol)	252.19
MDL Number	MFCD03701505
SMILES	CC(C)(C)[Si](C)(C)OC1=CC=CC(=C1)B(O)O
Synonym	3-tert-butyldimethylsilyl oxy phenyl boronic acid,3-tert-butyldimethylsilyloxy phenylboronic acid,3-t-butyldimethylsilyloxy phenylboronic acid,3-tert-butyl dimethylsiloxy phenyl boronic acid,3-tert-butyldimethylsilyloxy benzeneboronic acid,3-tert-butyldimethylsiloxy benzeneboronic acid,3-tert-butyldimethylsilyl oxy phenylboronic acid,3-tert-butyl dimethyl silyl oxyphenyl boronic acid,m-t-butyldimethylsilyloxy phenylboronic acid,3-t-butyl dimethylsiloxy phenyl boronic acid
IUPAC Name	[3-[tert-butyl(dimethyl)silyl]oxyphenyl]boronic acid
InChI Key	RDQWADDNQONTLB-UHFFFAOYSA-N
Molecular Formula	C12H21BO3Si

Neostigmine bromide

CAS: 114-80-7 Molecular Formula: C12H19BrN2O2 Molecular Weight (g/mol): 303.20 MDL Number: MFCD00011795 InChI Key: LULNWZDBKTWDGK-UHFFFAOYSA-M Synonym: neostigmine bromide,neo-proserin,eustigmin bromide,neoserine bromide,proserine bromide,stigmanol bromide,synstigmin bromide,leostigmine bromide,kirkstigmine bromide,philostigmin bromide PubChem CID: 8246 ChEBI: CHEBI:179557 IUPAC Name: 3-[(dimethylcarbamoyl)oxy]-N,N,N-trimethylanilinium bromide SMILES: [Br-].CN(C)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C

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PubChem CID	8246
CAS	114-80-7
Molecular Weight (g/mol)	303.20
ChEBI	CHEBI:179557
MDL Number	MFCD00011795
SMILES	[Br-].CN(C)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C
Synonym	neostigmine bromide,neo-proserin,eustigmin bromide,neoserine bromide,proserine bromide,stigmanol bromide,synstigmin bromide,leostigmine bromide,kirkstigmine bromide,philostigmin bromide
IUPAC Name	3-[(dimethylcarbamoyl)oxy]-N,N,N-trimethylanilinium bromide
InChI Key	LULNWZDBKTWDGK-UHFFFAOYSA-M
Molecular Formula	C12H19BrN2O2

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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2,5-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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Diphenylphosphonic azide, 97%

CAS: 26386-88-9 Molecular Formula: C12H10N3O3P Molecular Weight (g/mol): 275.20 MDL Number: MFCD00001987 InChI Key: SORGEQQSQGNZFI-UHFFFAOYSA-N Synonym: diphenylphosphoryl azide,diphenyl azidophosphate,diphenylphosphonic azide,diphenyl phosphoryl azide,diphenyl phosphorazidate,phosphorazidic acid, diphenyl ester,azido phenoxy phosphoryl oxy benzene,dppa polymer-bound,diphenylphosphorazidate,unii-gxm91165av PubChem CID: 123414 IUPAC Name: [azido(phenoxy)phosphoryl]oxybenzene SMILES: [N-]=[N+]=NP(=O)(OC1=CC=CC=C1)OC1=CC=CC=C1

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PubChem CID	123414
CAS	26386-88-9
Molecular Weight (g/mol)	275.20
MDL Number	MFCD00001987
SMILES	[N-]=[N+]=NP(=O)(OC1=CC=CC=C1)OC1=CC=CC=C1
Synonym	diphenylphosphoryl azide,diphenyl azidophosphate,diphenylphosphonic azide,diphenyl phosphoryl azide,diphenyl phosphorazidate,phosphorazidic acid, diphenyl ester,azido phenoxy phosphoryl oxy benzene,dppa polymer-bound,diphenylphosphorazidate,unii-gxm91165av
IUPAC Name	[azido(phenoxy)phosphoryl]oxybenzene
InChI Key	SORGEQQSQGNZFI-UHFFFAOYSA-N
Molecular Formula	C12H10N3O3P

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m-Phenetidine, 98%

CAS: 621-33-0 Molecular Formula: C8H11NO Molecular Weight (g/mol): 137.18 MDL Number: MFCD00007785 InChI Key: WEZAHYDFZNTGKE-UHFFFAOYSA-N Synonym: m-phenetidine,benzenamine, 3-ethoxy,m-ethoxyaniline,3-ethoxybenzenamine,unii-xe9kkl972r,ccris 4696,xe9kkl972r,3-ethoxyphenylamine,3-ethoxy aniline,3-ethoxy-phenylamine PubChem CID: 12120 IUPAC Name: 3-ethoxyaniline SMILES: CCOC1=CC=CC(N)=C1

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PubChem CID	12120
CAS	621-33-0
Molecular Weight (g/mol)	137.18
MDL Number	MFCD00007785
SMILES	CCOC1=CC=CC(N)=C1
Synonym	m-phenetidine,benzenamine, 3-ethoxy,m-ethoxyaniline,3-ethoxybenzenamine,unii-xe9kkl972r,ccris 4696,xe9kkl972r,3-ethoxyphenylamine,3-ethoxy aniline,3-ethoxy-phenylamine
IUPAC Name	3-ethoxyaniline
InChI Key	WEZAHYDFZNTGKE-UHFFFAOYSA-N
Molecular Formula	C8H11NO

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Ethyl 4-ethoxybenzoate, 98%

CAS: 23676-09-7 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00009116 InChI Key: HRAQMGWTPNOILP-UHFFFAOYSA-N Synonym: benzoic acid, 4-ethoxy-, ethyl ester,4-ethoxybenzoic acid ethyl ester,4-ethoxy ethylbenzoate,benzoic acid, p-ethoxy-, ethyl ester,4-ethoxyethylbenzoate,peeb,ethyl p-ethoxybenzoate,ethyl-4-ethoxybenzoate,p-ethoxy ethyl benzoate,ethyl-p-ethoxy benzoate PubChem CID: 90232 IUPAC Name: ethyl 4-ethoxybenzoate SMILES: CCOC1=CC=C(C=C1)C(=O)OCC

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PubChem CID	90232
CAS	23676-09-7
Molecular Weight (g/mol)	194.23
MDL Number	MFCD00009116
SMILES	CCOC1=CC=C(C=C1)C(=O)OCC
Synonym	benzoic acid, 4-ethoxy-, ethyl ester,4-ethoxybenzoic acid ethyl ester,4-ethoxy ethylbenzoate,benzoic acid, p-ethoxy-, ethyl ester,4-ethoxyethylbenzoate,peeb,ethyl p-ethoxybenzoate,ethyl-4-ethoxybenzoate,p-ethoxy ethyl benzoate,ethyl-p-ethoxy benzoate
IUPAC Name	ethyl 4-ethoxybenzoate
InChI Key	HRAQMGWTPNOILP-UHFFFAOYSA-N
Molecular Formula	C11H14O3

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