[4-(4-methoxyphenyl)oxan-4-yl]methanamine


Chemical Name: [4-(4-methoxyphenyl)oxan-4-yl]methanamine
CAS Number: 440087-51-4
Product Number: AG00DIH4(AGN-PC-0JY7OT)
Synonyms:
MDL No:
Molecular Formula: C13H19NO2
Molecular Weight: 221.2955

Identification/Properties


Computed Properties
Molecular Weight:
221.3g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
221.142g/mol
Monoisotopic Mass:
221.142g/mol
Topological Polar Surface Area:
44.5A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
206
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

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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