Bisphenol A Monobenzyl Ether


Chemical Name: Bisphenol A Monobenzyl Ether
CAS Number: 42781-88-4
Product Number: AG00C99Z(AGN-PC-0WAITI)
Synonyms:
MDL No:
Molecular Formula: C29H30O3
Molecular Weight: 426.5467

Identification/Properties


Computed Properties
Molecular Weight:
318.416g/mol
XLogP3:
6.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
5
Exact Mass:
318.162g/mol
Monoisotopic Mass:
318.162g/mol
Topological Polar Surface Area:
29.5A^2
Heavy Atom Count:
24
Formal Charge:
0
Complexity:
356
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
Compound Is Canonicalized:
Yes

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NMR Spectrum


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