Home Other Building Blocks {4-[(oxan-4-yloxy)methyl]phenyl}methanamine

{4-[(oxan-4-yloxy)methyl]phenyl}methanamine

CAS No.:
864266-78-4
Catalog Number:
AG01A20B
Molecular Formula:
C13H19NO2
Molecular Weight:
221.2955
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Product Description
Catalog Number:
AG01A20B
Chemical Name:
{4-[(oxan-4-yloxy)methyl]phenyl}methanamine
CAS Number:
864266-78-4
Molecular Formula:
C13H19NO2
Molecular Weight:
221.2955
MDL Number:
MFCD14614918
IUPAC Name:
[4-(oxan-4-yloxymethyl)phenyl]methanamine
InChI:
InChI=1S/C13H19NO2/c14-9-11-1-3-12(4-2-11)10-16-13-5-7-15-8-6-13/h1-4,13H,5-10,14H2
InChI Key:
AFOAYZQLYGSYAE-UHFFFAOYSA-N
SMILES:
NCc1ccc(cc1)COC1CCOCC1
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.142g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.3g/mol
Monoisotopic Mass:
221.142g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties