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Decane, 2-bromo-

CAT: 0931-T31325-02Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0931-T31325-02Size:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
39563-53-6
Target
Others
Related Pathways
Others
Bioactivity
Decane, 2-bromo- is a biochemical.
Smiles
CCCCCCCCC(C)Br
Molecular Formula
C10H21Br
Molecular Weight
221.18
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Decane, 2-bromo-
CAS Number39563-53-6
PubChem CID98297
IUPAC Name2-bromodecane
Molecular FormulaC10H21Br
Molecular Weight221.18
XLogP5.4
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count7
Heavy Atom Count11
Formal Charge0
Complexity71
SMILES
CCCCCCCCC(C)Br
InChI
InChI=1S/C10H21Br/c1-3-4-5-6-7-8-9-10(2)11/h10H,3-9H2,1-2H3
InChIKey
HRDKIHSQGRCTMR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Decane, 2-bromo-
CAS: 39563-53-6
CID: 98297
Formula: C10H21Br
MW: 221.18
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight221.18
XLogP35.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count7
Exact Mass220.08266
Monoisotopic Mass220.08266
Topological Polar Surface Area0 Ų
Heavy Atom Count11
Formal Charge0
Complexity71.3
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes