5-Bromo-2,4-difluorophenol

CAT: 0127-PC53121-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-PC53121-01Size:250 mg

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CAS Number

355423-48-2

MDL Number

MFCD20231458

Purity

95%

Smiles

Oc1cc(Br)c(F)cc1F

Storage Conditions

Store at 2-8°C

Chemical Information

5-Bromo-2,4-difluorophenol

CAS Number	355423-48-2
PubChem CID	9834300
IUPAC Name	5-bromo-2,4-difluorophenol
Molecular Formula	C6H3BrF2O
Molecular Weight	208.99
XLogP	2.5
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	10
Formal Charge	0
Complexity	122

SMILES

C1=C(C(=CC(=C1Br)F)F)O

InChI

InChI=1S/C6H3BrF2O/c7-3-1-6(10)5(9)2-4(3)8/h1-2,10H

InChIKey

ZLUWZDGMZGVBGM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 355423-48-2

CID: 9834300

Formula: C6H3BrF2O

MW: 208.99

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	208.99
XLogP3	2.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	207.93353
Monoisotopic Mass	207.93353
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	122
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
PC1393N	2-Bromo-4,5-difluorophenol
PC7898-01	4-Bromo-2,5-difluorophenol
PC8836-01	4-Bromo-3,5-difluorophenol
PC48654-01	3-Bromo-4,5-difluorophenol
PC1025716	4-bromo-2-chloro-3,5-difluorophenol
PC56338-01	3-Bromo-2,5-difluorophenol
PC8835-01	2-Bromo-3,5-difluorophenol
PC1452-01	5-Bromo-2,3-difluorophenol
PC1023600	2-bromo-3,4-difluorophenol
PC1209-01	4-Bromo-2,6-difluorophenol