Home Aminos [3,5-bis(aminomethyl)phenyl]methanamine trihydrobromide

[3,5-bis(aminomethyl)phenyl]methanamine trihydrobromide

CAS No.:
1864060-71-8
Catalog Number:
AG01AP03
Molecular Formula:
C9H18Br3N3
Molecular Weight:
407.9713
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Product Description
Catalog Number:
AG01AP03
Chemical Name:
[3,5-bis(aminomethyl)phenyl]methanamine trihydrobromide
CAS Number:
1864060-71-8
Molecular Formula:
C9H18Br3N3
Molecular Weight:
407.9713
MDL Number:
MFCD29034346
IUPAC Name:
[3,5-bis(aminomethyl)phenyl]methanamine;trihydrobromide
InChI:
InChI=1S/C9H15N3.3BrH/c10-4-7-1-8(5-11)3-9(2-7)6-12;;;/h1-3H,4-6,10-12H2;3*1H
InChI Key:
OABBSKICVFIANO-UHFFFAOYSA-N
SMILES:
NCc1cc(CN)cc(c1)CN.Br.Br.Br
Properties
Complexity:
91.2  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
4  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
406.903g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
6  
Isotope Atom Count:
0
Molecular Weight:
407.976g/mol
Monoisotopic Mass:
404.905g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
78.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties