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2-Octanol

CAT: 0931-T83989-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T83989-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
123-96-6
Target
Others
Related Pathways
Others
Purity
0.994
Bioactivity
Octan-2-ol is involved in the production of nanomaterials and liquid crystal materials.
Smiles
CCCCCCC(C)O
Molecular Formula
C8H18O
Molecular Weight
130.23
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2-Octanol

Octan-2-ol is an octanol carrying the hydroxy group at position 2. It has a role as a volatile oil component and a plant metabolite. It is a secondary alcohol and an octanol.

CAS Number123-96-6
PubChem CID20083
IUPAC Nameoctan-2-ol
Molecular FormulaC8H18O
Molecular Weight130.23
XLogP2.9
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count5
Heavy Atom Count9
Formal Charge0
Complexity52
SMILES
CCCCCCC(C)O
InChI
InChI=1S/C8H18O/c1-3-4-5-6-7-8(2)9/h8-9H,3-7H2,1-2H3
InChIKey
SJWFXCIHNDVPSH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Octanol
CAS: 123-96-6
CID: 20083
Formula: C8H18O
MW: 130.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight130.23
XLogP32.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count5
Exact Mass130.135765193
Monoisotopic Mass130.135765193
Topological Polar Surface Area20.2 Ų
Heavy Atom Count9
Formal Charge0
Complexity52.5
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

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Alternative Products

CatalogName
sc-238187(±) -2-Octanol
25531-222-Octanol
sc-250941A(S) - (+) -2-Octanol
sc-250847(R) - (-) -2-Octanol
OR10015-01(R) -2-Octanol
S-28802-Octanol - 1ML
17478884R) - (-) -2-Octanol
18605498-01S) - (+) -2-Octanol
O01253D-2-Octanol
O012502-Octanol 98%

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