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Octafluoro-4,4'-biphenol

CAT: 0572-TRC-O273108-100MGSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-O273108-100MGSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2200-70-6
Hazard Statement
Causes skin irritation.
Purity
>95% (HPLC)
Smiles
Oc1c(F)c(F)c(c(F)c1F)c2c(F)c(F)c(O)c(F)c2F
Molecular Formula
C12H2O2F8
Molecular Weight
330.13
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Octafluoro-4,4'-biphenol
CAS Number2200-70-6
PubChem CID630263
IUPAC Name2,3,5,6-tetrafluoro-4-(2,3,5,6-tetrafluoro-4-hydroxyphenyl)phenol
Molecular FormulaC12H2F8O2
Molecular Weight330.13
XLogP3.6
Topological Polar Surface Area40.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count10
Rotatable Bond Count1
Heavy Atom Count22
Formal Charge0
Complexity333
SMILES
C1(=C(C(=C(C(=C1F)F)O)F)F)C2=C(C(=C(C(=C2F)F)O)F)F
InChI
InChI=1S/C12H2F8O2/c13-3-1(4(14)8(18)11(21)7(3)17)2-5(15)9(19)12(22)10(20)6(2)16/h21-22H
InChIKey
MOFZHBRFFAIMKM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Octafluoro-4,4'-biphenol
CAS: 2200-70-6
CID: 630263
Formula: C12H2F8O2
MW: 330.13
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight330.13
XLogP33.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count10
Rotatable Bond Count1
Exact Mass329.99270460
Monoisotopic Mass329.99270460
Topological Polar Surface Area40.5 Ų
Heavy Atom Count22
Formal Charge0
Complexity333
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
sc-487832Octafluoro-4,4'-biphenol
JH9139894,4'-Biphenol
PC10152,2',3,3',5,5',6,6'-Octafluoro-4,4'-biphenol monohydrate
B7270-014,4'- (1-Phenylethylidene) biphenol
O00720-01Octafluoro-4 4'-Dimethoxybiphenyl 98%
EIA315814,4'-Diiodo-2,2'-biphenol
286365-01Octafluoro-1,4-diiodobutane
sc-4860453,3'-Dibromo-4,4'-biphenol
OR10098832,2',6,6'-Tetramethyl-4,4'-biphenol
sc-2248631,1,2,2,3,3,4,4-Octafluoro-5-iodopentane

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