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Chemical Product CAS:52373-05-45-(methylamino)-5,6,7,8-tetrahydronaphthalen-2-ol


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5-(methylamino)-5,6,7,8-tetrahydronaphthalen- ( CASNO:52373-05-4 )

Identification and Related Records
CAS Registry number:
Iupac name:
2-naphthalenol, 5,6,7,8-tetrahydro-5-(methylamino)-
Molecular Formula:
Molecular Weight:
Canonical SMILES:
Chemical and Physical Properties
Boiling Point:
330.3°C at 760 mmHg
Refractive Index:
Flash Point:
Computed Properties:
Molecular Weight:177.2429 [g/mol]
Molecular Formula:C11H15NO
H-Bond Donor:2
H-Bond Acceptor:2
Rotatable Bond Count:1
Tautomer Count:9
Exact Mass:177.115364
MonoIsotopic Mass:177.115364
Topological Polar Surface Area:32.3
Heavy Atom Count:13
Formal Charge:0
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Donor Count:2
Feature 3D Cation Count:1
Feature 3D Ring Count:2
Effective Rotor Count:1.8
Conformer Sampling RMSD:0.6
CID Conformer Count:3
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