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1-Bromo-6-fluorohexane

CAT: 0127-PC1004005-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-PC1004005-01Size:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
373-28-4
MDL Number
MFCD01723470
Purity
95%
Smiles
FCCCCCCBr

Chemical Information

1-Bromo-6-fluorohexane
CAS Number373-28-4
PubChem CID9765
IUPAC Name1-bromo-6-fluorohexane
Molecular FormulaC6H12BrF
Molecular Weight183.06
XLogP2.8
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count5
Heavy Atom Count8
Formal Charge0
Complexity39
SMILES
C(CCCBr)CCF
InChI
InChI=1S/C6H12BrF/c7-5-3-1-2-4-6-8/h1-6H2
InChIKey
CNCUKGDUDOASDV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Bromo-6-fluorohexane
CAS: 373-28-4
CID: 9765
Formula: C6H12BrF
MW: 183.06
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight183.06
XLogP32.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count5
Exact Mass182.01064
Monoisotopic Mass182.01064
Topological Polar Surface Area0 Ų
Heavy Atom Count8
Formal Charge0
Complexity39.5
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