Home Other Building Blocks 3-(azepan-1-yl)aniline

3-(azepan-1-yl)aniline

CAS No.:
141515-10-8
Catalog Number:
AG01AKEP
Molecular Formula:
C12H18N2
Molecular Weight:
190.2847
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Product Description
Catalog Number:
AG01AKEP
Chemical Name:
3-(azepan-1-yl)aniline
CAS Number:
141515-10-8
Molecular Formula:
C12H18N2
Molecular Weight:
190.2847
MDL Number:
MFCD11132670
IUPAC Name:
3-(azepan-1-yl)aniline
InChI:
InChI=1S/C12H18N2/c13-11-6-5-7-12(10-11)14-8-3-1-2-4-9-14/h5-7,10H,1-4,8-9,13H2
InChI Key:
TYBMLDBFQFHCSG-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)N1CCCCCC1
Properties
Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.147g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.29g/mol
Monoisotopic Mass:
190.147g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties