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6-Undecanol

CAT: 0572-TRC-U788805-500MGSize: 500 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-U788805-500MGSize:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
23708-56-7
Hazard Statement
Flammable solid; UN number: UN1325; Packing Group: III
Purity
>95% (GC)
Smiles
CCCCCC(O)CCCCC
Molecular Formula
C11H24O
Molecular Weight
172.3
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

6-Undecanol

Undecan-6-ol is a secondary alcohol that is undecane substituted by a hydroxy group at position 6. It is an undecanol and a secondary alcohol.

CAS Number23708-56-7
PubChem CID32045
IUPAC Nameundecan-6-ol
Molecular FormulaC11H24O
Molecular Weight172.31
XLogP4.3
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count8
Heavy Atom Count12
Formal Charge0
Complexity71
SMILES
CCCCCC(CCCCC)O
InChI
InChI=1S/C11H24O/c1-3-5-7-9-11(12)10-8-6-4-2/h11-12H,3-10H2,1-2H3
InChIKey
YBIXBBGRHOUVBB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 6-Undecanol
CAS: 23708-56-7
CID: 32045
Formula: C11H24O
MW: 172.31
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight172.31
XLogP34.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count8
Exact Mass172.182715385
Monoisotopic Mass172.182715385
Topological Polar Surface Area20.2 Ų
Heavy Atom Count12
Formal Charge0
Complexity71.1
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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