Home Other Building Blocks [2-(azepan-1-ylmethyl)phenyl]methanamine

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

CAS No.:
75545-79-8
Catalog Number:
AG01AHTS
Molecular Formula:
C14H22N2
Molecular Weight:
218.3379
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Product Description
Catalog Number:
AG01AHTS
Chemical Name:
[2-(azepan-1-ylmethyl)phenyl]methanamine
CAS Number:
75545-79-8
Molecular Formula:
C14H22N2
Molecular Weight:
218.3379
MDL Number:
MFCD08444584
IUPAC Name:
[2-(azepan-1-ylmethyl)phenyl]methanamine
InChI:
InChI=1S/C14H22N2/c15-11-13-7-3-4-8-14(13)12-16-9-5-1-2-6-10-16/h3-4,7-8H,1-2,5-6,9-12,15H2
InChI Key:
ZCAYBUPHLOBUEQ-UHFFFAOYSA-N
SMILES:
NCc1ccccc1CN1CCCCCC1
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