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145409-13-8 | 1,8-Octanediamine, N1,N8-bis(1-naphthalenylmethyl)-
CAS No: 145409-13-8 Catalog No: AG001KUT MDL No:
Product Description
Catalog Number:
AG001KUT
Chemical Name:
1,8-Octanediamine, N1,N8-bis(1-naphthalenylmethyl)-
CAS Number:
145409-13-8
Molecular Formula:
C30H36N2
Molecular Weight:
424.6202
IUPAC Name:
N,N'-bis(naphthalen-1-ylmethyl)octane-1,8-diamine
InChI:
InChI=1S/C30H36N2/c1(3-9-21-31-23-27-17-11-15-25-13-5-7-19-29(25)27)2-4-10-22-32-24-28-18-12-16-26-14-6-8-20-30(26)28/h5-8,11-20,31-32H,1-4,9-10,21-24H2
InChI Key:
RUSAGYULHXYFNT-UHFFFAOYSA-N
SMILES:
C(CCCNCc1cccc2c1cccc2)CCCCNCc1cccc2c1cccc2
NSC Number:
629733
Properties
Complexity:
447
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
424.288g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
424.632g/mol
Monoisotopic Mass:
424.288g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.4
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