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Home> Hot Product Listed P   > p-(tert-butyl)benzyl acetate

p-(tert-butyl)benzyl acetate

CAS No.:67364-88-9
EINECS(EC#):266-669-8
Molecular Weight:206.28082
Molecular Formula:C13H18O2 (Products with the same molecular formula)
MOL File:67364-88-9.mol
Properties
Density
0.987g/cm3
Boiling Point
265.8°C at 760 mmHg
Refractive Index
1.491
Flash Point
97°C
Reach Info
Computational chemical data

Molecular Weight:206.28082 [g/mol]
Molecular Formula:C13H18O2
XLogP3:3.7
H-Bond Donor:0
H-Bond Acceptor:2
Rotatable Bond Count:4
Exact Mass:206.13068
MonoIsotopic Mass:206.13068
Topological Polar Surface Area:26.3
Heavy Atom Count:15
Formal Charge:0
Complexity:207
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:1
Feature 3D Hydrophobe Count:1
Feature 3D Ring Count:1
Effective Rotor Count:4
Conformer Sampling RMSD:0.6
CID Conformer Count:8