Home Other Building Blocks 4-(oxan-4-ylmethoxy)aniline

4-(oxan-4-ylmethoxy)aniline

CAS No.:
1249599-74-3
Catalog Number:
AG01AJRE
Molecular Formula:
C12H17NO2
Molecular Weight:
207.2689
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Product Description
Catalog Number:
AG01AJRE
Chemical Name:
4-(oxan-4-ylmethoxy)aniline
CAS Number:
1249599-74-3
Molecular Formula:
C12H17NO2
Molecular Weight:
207.2689
MDL Number:
MFCD16745314
IUPAC Name:
4-(oxan-4-ylmethoxy)aniline
InChI:
InChI=1S/C12H17NO2/c13-11-1-3-12(4-2-11)15-9-10-5-7-14-8-6-10/h1-4,10H,5-9,13H2
InChI Key:
VGQWFBBLLKGMTM-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)OCC1CCOCC1
Properties
Complexity:
173  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.126g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
207.273g/mol
Monoisotopic Mass:
207.126g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties