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Beta-Tetralone

CAT: 0013-GTR19162131-02Size: 1 gDry Ice: NoHazardous: No
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CAT#:0013-GTR19162131-02Size:1 g
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Description
2-Tetralone is an organic chemical compound with the molecular formula C10H10O. This colourless oil is an intermediate in organic synthesis. It is a ketone derivative of tetralin, a hydrogenated derivative of naphthalene. A related compound is 1-tetralone.
CAS Number
530-93-8
Product Name Alternative
Beta-Tetralone | AI3-12003 | AI3 12003 | AI312003
Purity
>98% (HPLC)
Solubility
Soluble in DMSO
Smiles
O=C1CC2=C (C=CC=C2) CC1
Molecular Formula
C10H10O
Molecular Weight
146.19
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.
Other Product Names
1,2,3,4-Tetrahydronaphthalen-2-one

Chemical Information

2-Tetralone
CAS Number530-93-8
PubChem CID68266
IUPAC Name3,4-dihydro-1H-naphthalen-2-one
Molecular FormulaC10H10O
Molecular Weight146.19
XLogP1.6
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity162
SMILES
C1CC2=CC=CC=C2CC1=O
InChI
InChI=1S/C10H10O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-4H,5-7H2
InChIKey
KCKZIWSINLBROE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Tetralone
CAS: 530-93-8
CID: 68266
Formula: C10H10O
MW: 146.19
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight146.19
XLogP31.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass146.073164938
Monoisotopic Mass146.073164938
Topological Polar Surface Area17.1 Ų
Heavy Atom Count11
Formal Charge0
Complexity162
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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