Home Other Building Blocks 3-(oxan-4-yl)aniline

3-(oxan-4-yl)aniline

CAS No.:
1202006-13-0
Catalog Number:
AG01BVUQ
Molecular Formula:
C11H15NO
Molecular Weight:
177.2429
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Product Description
Catalog Number:
AG01BVUQ
Chemical Name:
3-(oxan-4-yl)aniline
CAS Number:
1202006-13-0
Molecular Formula:
C11H15NO
Molecular Weight:
177.2429
MDL Number:
MFCD21099826
IUPAC Name:
3-(oxan-4-yl)aniline
InChI:
InChI=1S/C11H15NO/c12-11-3-1-2-10(8-11)9-4-6-13-7-5-9/h1-3,8-9H,4-7,12H2
InChI Key:
LRCBWZYCGVEGAR-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)C1CCOCC1
Properties
Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.115g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
177.247g/mol
Monoisotopic Mass:
177.115g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties