Home Other Building Blocks [3-(azepan-1-ylmethyl)phenyl]methanamine

[3-(azepan-1-ylmethyl)phenyl]methanamine

CAS No.:
876716-70-0
Catalog Number:
AG01A7UH
Molecular Formula:
C14H22N2
Molecular Weight:
218.3379
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Product Description
Catalog Number:
AG01A7UH
Chemical Name:
[3-(azepan-1-ylmethyl)phenyl]methanamine
CAS Number:
876716-70-0
Molecular Formula:
C14H22N2
Molecular Weight:
218.3379
MDL Number:
MFCD07801132
IUPAC Name:
[3-(azepan-1-ylmethyl)phenyl]methanamine
InChI:
InChI=1S/C14H22N2/c15-11-13-6-5-7-14(10-13)12-16-8-3-1-2-4-9-16/h5-7,10H,1-4,8-9,11-12,15H2
InChI Key:
SUTMDIQABALFGJ-UHFFFAOYSA-N
SMILES:
NCc1cccc(c1)CN1CCCCCC1
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.178g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
218.344g/mol
Monoisotopic Mass:
218.178g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties