4-(Benzyloxy)-2-((dimethylamino)methyl)-1-(3-methoxyphenyl)cyclohexanol


Chemical Name: 4-(Benzyloxy)-2-((dimethylamino)methyl)-1-(3-methoxyphenyl)cyclohexanol
CAS Number: 413587-97-0
Product Number: AG00I838(AGN-PC-0WAMBW)
Synonyms:
MDL No:
Molecular Formula: C23H31NO3
Molecular Weight: 369.4971

Identification/Properties


Computed Properties
Molecular Weight:
369.505g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
7
Exact Mass:
369.23g/mol
Monoisotopic Mass:
369.23g/mol
Topological Polar Surface Area:
41.9A^2
Heavy Atom Count:
27
Formal Charge:
0
Complexity:
437
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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