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Tetralin 98.0%

CAT: 0459-030373-01Size: 500 mLDry Ice: NoHazardous: No
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CAT#:0459-030373-01Size:500 mL
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CAS Number
119-64-2

Chemical Information

Tetralin

Tetralin is an ortho-fused bicyclic hydrocarbon that is 1,2,3,4-tetrahydro derivative of naphthalene. It is an ortho-fused bicyclic hydrocarbon and a member of tetralins. It derives from a hydride of a naphthalene.

CAS Number119-64-2
PubChem CID8404
IUPAC Name1,2,3,4-tetrahydronaphthalene
Molecular FormulaC10H12
Molecular Weight132.20
XLogP3.5
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Heavy Atom Count10
Formal Charge0
Complexity92
SMILES
C1CCC2=CC=CC=C2C1
InChI
InChI=1S/C10H12/c1-2-6-10-8-4-3-7-9(10)5-1/h1-2,5-6H,3-4,7-8H2
InChIKey
CXWXQJXEFPUFDZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Tetralin
CAS: 119-64-2
CID: 8404
Formula: C10H12
MW: 132.20
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight132.20
XLogP33.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass132.093900383
Monoisotopic Mass132.093900383
Topological Polar Surface Area0 Ų
Heavy Atom Count10
Formal Charge0
Complexity92.6
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