Halophenols

Organic compounds derived from phenols that contain a halogen atom (bromine, chlorine, fluorine, iodine).

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4-Chloro-2-nitrophenol, 98%, contains up to ca 10% water, Thermo Scientific Chemicals

CAS: 89-64-5 Molecular Formula: C6H4ClNO3 Molecular Weight (g/mol): 173.55 MDL Number: MFCD00007113 InChI Key: NWSIFTLPLKCTSX-UHFFFAOYSA-N Synonym: 2-nitro-4-chlorophenol,phenol, 4-chloro-2-nitro,unii-438lq62wnh,4-chloro-2-nitro-phenol,4-chloro-6-nitrophenol,acmc-209r2b,5-chloro-2-hydroxynitrobenzene,4-chloro-2-nitrophenol PubChem CID: 6980 IUPAC Name: 4-chloro-2-nitrophenol SMILES: OC1=CC=C(Cl)C=C1[N+]([O-])=O

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PubChem CID	6980
CAS	89-64-5
Molecular Weight (g/mol)	173.55
MDL Number	MFCD00007113
SMILES	OC1=CC=C(Cl)C=C1[N+]([O-])=O
Synonym	2-nitro-4-chlorophenol,phenol, 4-chloro-2-nitro,unii-438lq62wnh,4-chloro-2-nitro-phenol,4-chloro-6-nitrophenol,acmc-209r2b,5-chloro-2-hydroxynitrobenzene,4-chloro-2-nitrophenol
IUPAC Name	4-chloro-2-nitrophenol
InChI Key	NWSIFTLPLKCTSX-UHFFFAOYSA-N
Molecular Formula	C6H4ClNO3

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2,3-Difluoro-4-hydroxybenzonitrile, 95%, Thermo Scientific Chemicals

CAS: 126162-38-7 Molecular Formula: C7H3F2NO Molecular Weight (g/mol): 155.10 MDL Number: MFCD00269596 InChI Key: UIJJJWADIVZXNT-UHFFFAOYSA-N PubChem CID: 2736978 IUPAC Name: 2,3-difluoro-4-hydroxybenzonitrile SMILES: OC1=C(F)C(F)=C(C=C1)C#N

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Specifications

PubChem CID	2736978
CAS	126162-38-7
Molecular Weight (g/mol)	155.10
MDL Number	MFCD00269596
SMILES	OC1=C(F)C(F)=C(C=C1)C#N
IUPAC Name	2,3-difluoro-4-hydroxybenzonitrile
InChI Key	UIJJJWADIVZXNT-UHFFFAOYSA-N
Molecular Formula	C7H3F2NO

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2-Fluoro-6-nitrophenol, 98+%

CAS: 1526-17-6 Molecular Formula: C6H4FNO3 Molecular Weight (g/mol): 157.10 MDL Number: MFCD00042446 InChI Key: HIGRXCJEFUYRNW-UHFFFAOYSA-N Synonym: 2-fluoro-6-nitrophenol,6-fluoro-2-nitrophenol,phenol, 2-fluoro-6-nitro,2-nitro-6-fluorophenol,2-fluoro-6-nitro-phenol,3-fluoro-2-hydroxynitrobenzene,fluoro-6-nitrophenol, 2,2-fluoro-6-nitrophen,pubchem10654,2-fluor-6-nitrophenol PubChem CID: 73710 IUPAC Name: 2-fluoro-6-nitrophenol SMILES: OC1=C(F)C=CC=C1[N+]([O-])=O

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Specifications

PubChem CID	73710
CAS	1526-17-6
Molecular Weight (g/mol)	157.10
MDL Number	MFCD00042446
SMILES	OC1=C(F)C=CC=C1[N+]([O-])=O
Synonym	2-fluoro-6-nitrophenol,6-fluoro-2-nitrophenol,phenol, 2-fluoro-6-nitro,2-nitro-6-fluorophenol,2-fluoro-6-nitro-phenol,3-fluoro-2-hydroxynitrobenzene,fluoro-6-nitrophenol, 2,2-fluoro-6-nitrophen,pubchem10654,2-fluor-6-nitrophenol
IUPAC Name	2-fluoro-6-nitrophenol
InChI Key	HIGRXCJEFUYRNW-UHFFFAOYSA-N
Molecular Formula	C6H4FNO3

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4-Bromo-3-fluorophenol, 98%

CAS: 121219-03-2 Molecular Formula: C6H4BrFO Molecular Weight (g/mol): 190.999 MDL Number: MFCD00051907 InChI Key: MRQYTJXVULSNIS-UHFFFAOYSA-N Synonym: 3-fluoro-4-bromophenol,4-bromo-3-fluoro-phenol,phenol, 4-bromo-3-fluoro,pubchem1489,4-bromo-3-flourophenol,3-fluoro-4-bromo phenol,3-fluoro-4-bromo-phenol,4-bromo-3-fluoro phenol,4-bromo-5-fluoro-phenol,acmc-209a9m PubChem CID: 2779153 IUPAC Name: 4-bromo-3-fluorophenol SMILES: C1=CC(=C(C=C1O)F)Br

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Specifications

PubChem CID	2779153
CAS	121219-03-2
Molecular Weight (g/mol)	190.999
MDL Number	MFCD00051907
SMILES	C1=CC(=C(C=C1O)F)Br
Synonym	3-fluoro-4-bromophenol,4-bromo-3-fluoro-phenol,phenol, 4-bromo-3-fluoro,pubchem1489,4-bromo-3-flourophenol,3-fluoro-4-bromo phenol,3-fluoro-4-bromo-phenol,4-bromo-3-fluoro phenol,4-bromo-5-fluoro-phenol,acmc-209a9m
IUPAC Name	4-bromo-3-fluorophenol
InChI Key	MRQYTJXVULSNIS-UHFFFAOYSA-N
Molecular Formula	C6H4BrFO

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2-Bromo-6-methoxyphenol, 98+%

CAS: 28165-49-3 Molecular Formula: C7H7BrO2 Molecular Weight (g/mol): 203.035 MDL Number: MFCD08146628 InChI Key: WEUFQISIJPSTBM-UHFFFAOYSA-N PubChem CID: 11019958 IUPAC Name: 2-bromo-6-methoxyphenol SMILES: COC1=C(C(=CC=C1)Br)O

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Specifications

PubChem CID	11019958
CAS	28165-49-3
Molecular Weight (g/mol)	203.035
MDL Number	MFCD08146628
SMILES	COC1=C(C(=CC=C1)Br)O
IUPAC Name	2-bromo-6-methoxyphenol
InChI Key	WEUFQISIJPSTBM-UHFFFAOYSA-N
Molecular Formula	C7H7BrO2

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4-Hydroxy-3,5-diiodobenzoic acid, 97%

CAS: 618-76-8 Molecular Formula: C7H4I2O3 Molecular Weight (g/mol): 389.92 MDL Number: MFCD00016532 InChI Key: XREKTVACBXQCSB-UHFFFAOYSA-N Synonym: 3,5-diiodo-4-hydroxybenzoic acid,ioxynil acid,ioxynic acid,benzoic acid, 4-hydroxy-3,5-diiodo,unii-8c0qv5jk0d,4-hydroxy-3,5-diiodo-benzoic acid,8c0qv5jk0d,chembl83650,benzoic acid, 3,5-diiodo-4-hydroxy,acmc-1b674 PubChem CID: 12065 IUPAC Name: 4-hydroxy-3,5-diiodobenzoic acid SMILES: OC(=O)C1=CC(I)=C(O)C(I)=C1

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Specifications

PubChem CID	12065
CAS	618-76-8
Molecular Weight (g/mol)	389.92
MDL Number	MFCD00016532
SMILES	OC(=O)C1=CC(I)=C(O)C(I)=C1
Synonym	3,5-diiodo-4-hydroxybenzoic acid,ioxynil acid,ioxynic acid,benzoic acid, 4-hydroxy-3,5-diiodo,unii-8c0qv5jk0d,4-hydroxy-3,5-diiodo-benzoic acid,8c0qv5jk0d,chembl83650,benzoic acid, 3,5-diiodo-4-hydroxy,acmc-1b674
IUPAC Name	4-hydroxy-3,5-diiodobenzoic acid
InChI Key	XREKTVACBXQCSB-UHFFFAOYSA-N
Molecular Formula	C7H4I2O3

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2-Chloro-4-nitrophenol, 97%

CAS: 619-08-9 Molecular Formula: C6H4ClNO3 Molecular Weight (g/mol): 173.552 MDL Number: MFCD00043910 InChI Key: BOFRXDMCQRTGII-UHFFFAOYSA-N Synonym: 2-chloro-4-nitrophenol,nitrofungin,phenol, 2-chloro-4-nitro,2-chloro-4-nitro phenol,nitrofurgin,phenol, chloro-4-nitro,unii-y2v03m9ul8,2-chloro-4-nitro-phenol,2-chloro-4nitrophenol,pubchem18908 PubChem CID: 12074 SMILES: C1=CC(=C(C=C1[N+](=O)[O-])Cl)O

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Specifications

PubChem CID	12074
CAS	619-08-9
Molecular Weight (g/mol)	173.552
MDL Number	MFCD00043910
SMILES	C1=CC(=C(C=C1[N+](=O)[O-])Cl)O
Synonym	2-chloro-4-nitrophenol,nitrofungin,phenol, 2-chloro-4-nitro,2-chloro-4-nitro phenol,nitrofurgin,phenol, chloro-4-nitro,unii-y2v03m9ul8,2-chloro-4-nitro-phenol,2-chloro-4nitrophenol,pubchem18908
InChI Key	BOFRXDMCQRTGII-UHFFFAOYSA-N
Molecular Formula	C6H4ClNO3

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2-Iodophenol, 98%

CAS: 533-58-4 Molecular Formula: C6H5IO Molecular Weight (g/mol): 220.01 MDL Number: MFCD00013963 InChI Key: KQDJTBPASNJQFQ-UHFFFAOYSA-N Synonym: o-iodophenol,phenol, 2-iodo,phenol, o-iodo,o-jodfenol,2-jodfenol,phenol, iodo,o-jodfenol czech,2-jodfenol czech,o-jodphenol,2-iodanylphenol PubChem CID: 10784 ChEBI: CHEBI:16706 IUPAC Name: 2-iodophenol SMILES: OC1=CC=CC=C1I

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Specifications

PubChem CID	10784
CAS	533-58-4
Molecular Weight (g/mol)	220.01
ChEBI	CHEBI:16706
MDL Number	MFCD00013963
SMILES	OC1=CC=CC=C1I
Synonym	o-iodophenol,phenol, 2-iodo,phenol, o-iodo,o-jodfenol,2-jodfenol,phenol, iodo,o-jodfenol czech,2-jodfenol czech,o-jodphenol,2-iodanylphenol
IUPAC Name	2-iodophenol
InChI Key	KQDJTBPASNJQFQ-UHFFFAOYSA-N
Molecular Formula	C6H5IO

3-Chlorophenol, 99%

CAS: 108-43-0 Molecular Formula: C6H5ClO Molecular Weight (g/mol): 128.56 MDL Number: MFCD00002256 InChI Key: HORNXRXVQWOLPJ-UHFFFAOYSA-N Synonym: m-chlorophenol,phenol, 3-chloro,phenol, m-chloro,3-hydroxychlorobenzene,m-chlorophenic acid,meta-chlorophenol,unii-z2z7m2ftad,3-chloro-1-hydroxybenzene,3-chloro-phenol,ccris 641 PubChem CID: 7933 ChEBI: CHEBI:38855 IUPAC Name: 3-chlorophenol SMILES: OC1=CC=CC(Cl)=C1

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PubChem CID	7933
CAS	108-43-0
Molecular Weight (g/mol)	128.56
ChEBI	CHEBI:38855
MDL Number	MFCD00002256
SMILES	OC1=CC=CC(Cl)=C1
Synonym	m-chlorophenol,phenol, 3-chloro,phenol, m-chloro,3-hydroxychlorobenzene,m-chlorophenic acid,meta-chlorophenol,unii-z2z7m2ftad,3-chloro-1-hydroxybenzene,3-chloro-phenol,ccris 641
IUPAC Name	3-chlorophenol
InChI Key	HORNXRXVQWOLPJ-UHFFFAOYSA-N
Molecular Formula	C6H5ClO

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2-Chloro-5-fluorophenol, 98%, Thermo Scientific™

CAS: 3827-49-4 Molecular Formula: C6H4ClFO Molecular Weight (g/mol): 146.55 MDL Number: MFCD00042524 InChI Key: CMQOZIKIOASEIN-UHFFFAOYSA-N Synonym: 2-chloro-5-fluoro-phenol,pubchem2146,2-chloro-5-fluorphenol,acmc-209iz2,ksc226k0t,attercop-chm at137231 PubChem CID: 2724522 IUPAC Name: 2-chloro-5-fluorophenol SMILES: OC1=CC(F)=CC=C1Cl

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Specifications

PubChem CID	2724522
CAS	3827-49-4
Molecular Weight (g/mol)	146.55
MDL Number	MFCD00042524
SMILES	OC1=CC(F)=CC=C1Cl
Synonym	2-chloro-5-fluoro-phenol,pubchem2146,2-chloro-5-fluorphenol,acmc-209iz2,ksc226k0t,attercop-chm at137231
IUPAC Name	2-chloro-5-fluorophenol
InChI Key	CMQOZIKIOASEIN-UHFFFAOYSA-N
Molecular Formula	C6H4ClFO

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2,6-Difluoro-4-hydroxybenzoic acid, 95%

CAS: 214917-68-7 Molecular Formula: C7H4F2O3 Molecular Weight (g/mol): 174.10 MDL Number: MFCD03094500 InChI Key: NFIQGYBXSJQLSR-UHFFFAOYSA-N Synonym: 2,6-difluoro-4-hydroxy-benzoic acid,benzoic acid, 2,6-difluoro-4-hydroxy,pubchem4938,acmc-1cles,ksc495o6f,4-carboxy-3,5-difluorophenol PubChem CID: 2778776 IUPAC Name: 2,6-difluoro-4-hydroxybenzoic acid SMILES: OC(=O)C1=C(F)C=C(O)C=C1F

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Specifications

PubChem CID	2778776
CAS	214917-68-7
Molecular Weight (g/mol)	174.10
MDL Number	MFCD03094500
SMILES	OC(=O)C1=C(F)C=C(O)C=C1F
Synonym	2,6-difluoro-4-hydroxy-benzoic acid,benzoic acid, 2,6-difluoro-4-hydroxy,pubchem4938,acmc-1cles,ksc495o6f,4-carboxy-3,5-difluorophenol
IUPAC Name	2,6-difluoro-4-hydroxybenzoic acid
InChI Key	NFIQGYBXSJQLSR-UHFFFAOYSA-N
Molecular Formula	C7H4F2O3

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2-Bromophenol, 98%

CAS: 95-56-7 Molecular Formula: C6H5BrO Molecular Weight (g/mol): 173.009 MDL Number: MFCD00002146 InChI Key: VADKRMSMGWJZCF-UHFFFAOYSA-N Synonym: o-bromophenol,phenol, 2-bromo,bromophenol,2-bromfenol,2-bromo phenol,2-bromo-phenol,phenol, o-bromo,o-bromo-phenol,phenol, bromo,2-bromfenol czech PubChem CID: 7244 IUPAC Name: 2-bromophenol SMILES: C1=CC=C(C(=C1)O)Br

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Specifications

PubChem CID	7244
CAS	95-56-7
Molecular Weight (g/mol)	173.009
MDL Number	MFCD00002146
SMILES	C1=CC=C(C(=C1)O)Br
Synonym	o-bromophenol,phenol, 2-bromo,bromophenol,2-bromfenol,2-bromo phenol,2-bromo-phenol,phenol, o-bromo,o-bromo-phenol,phenol, bromo,2-bromfenol czech
IUPAC Name	2-bromophenol
InChI Key	VADKRMSMGWJZCF-UHFFFAOYSA-N
Molecular Formula	C6H5BrO

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4-Bromophenol, 97%

CAS: 106-41-2 Molecular Formula: C₆H₅BrO Molecular Weight (g/mol): 173.01 MDL Number: MFCD00002313 InChI Key: GZFGOTFRPZRKDS-UHFFFAOYSA-N Synonym: p-bromophenol,phenol, 4-bromo,p-bromohydroxybenzene,4-bromo-phenol,p-bromophenic acid,phenol, p-bromo,para-bromophenol,4-bromo phenol,unii-lao4j0183i,ccris 632 PubChem CID: 7808 IUPAC Name: 4-bromophenol SMILES: C1=CC(=CC=C1O)Br

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PubChem CID	7808
CAS	106-41-2
Molecular Weight (g/mol)	173.01
MDL Number	MFCD00002313
SMILES	C1=CC(=CC=C1O)Br
Synonym	p-bromophenol,phenol, 4-bromo,p-bromohydroxybenzene,4-bromo-phenol,p-bromophenic acid,phenol, p-bromo,para-bromophenol,4-bromo phenol,unii-lao4j0183i,ccris 632
IUPAC Name	4-bromophenol
InChI Key	GZFGOTFRPZRKDS-UHFFFAOYSA-N
Molecular Formula	C₆H₅BrO

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2,6-Difluoro-4-iodophenol, 99%

CAS: 950858-06-7 Molecular Formula: C6H3F2IO Molecular Weight (g/mol): 255.99 MDL Number: MFCD09907951 InChI Key: LHUADYKKTXZZMQ-UHFFFAOYSA-N PubChem CID: 45790937 IUPAC Name: 2,6-difluoro-4-iodophenol SMILES: C1=C(C=C(C(=C1F)O)F)I

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Specifications

PubChem CID	45790937
CAS	950858-06-7
Molecular Weight (g/mol)	255.99
MDL Number	MFCD09907951
SMILES	C1=C(C=C(C(=C1F)O)F)I
IUPAC Name	2,6-difluoro-4-iodophenol
InChI Key	LHUADYKKTXZZMQ-UHFFFAOYSA-N
Molecular Formula	C6H3F2IO

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4-Amino-3-chlorophenol hydrochloride, 98%

CAS: 52671-64-4 Molecular Formula: C6H7Cl2NO Molecular Weight (g/mol): 180.028 MDL Number: MFCD00143110 InChI Key: RFJVQGMBFQGZPV-UHFFFAOYSA-N Synonym: 4-amino-3-chlorophenol hydrochloride,4-amino-3-chlorophenol hcl,2-chloro-4-hydroxyaniline hydrochloride,phenol, 4-amino-3-chloro-, hydrochloride,4-azanyl-3-chloranyl-phenol hydrochloride,c6h6clno.hcl,acmc-209l0t,ksc495i8f,4-amino-3-chlorophenol, chloride,3-chloro-4-aminophenol hydrochloride PubChem CID: 12598190 IUPAC Name: 4-amino-3-chlorophenol;hydrochloride SMILES: C1=CC(=C(C=C1O)Cl)N.Cl

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Specifications

PubChem CID	12598190
CAS	52671-64-4
Molecular Weight (g/mol)	180.028
MDL Number	MFCD00143110
SMILES	C1=CC(=C(C=C1O)Cl)N.Cl
Synonym	4-amino-3-chlorophenol hydrochloride,4-amino-3-chlorophenol hcl,2-chloro-4-hydroxyaniline hydrochloride,phenol, 4-amino-3-chloro-, hydrochloride,4-azanyl-3-chloranyl-phenol hydrochloride,c6h6clno.hcl,acmc-209l0t,ksc495i8f,4-amino-3-chlorophenol, chloride,3-chloro-4-aminophenol hydrochloride
IUPAC Name	4-amino-3-chlorophenol;hydrochloride
InChI Key	RFJVQGMBFQGZPV-UHFFFAOYSA-N
Molecular Formula	C6H7Cl2NO

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