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209669-44-3 | 1,2-Ethanediamine, N1,N2-bis(9-anthracenylmethyl)-
CAS No: 209669-44-3 Catalog No: AG002KCS MDL No:
Product Description
Catalog Number:
AG002KCS
Chemical Name:
1,2-Ethanediamine, N1,N2-bis(9-anthracenylmethyl)-
CAS Number:
209669-44-3
Molecular Formula:
C32H28N2
Molecular Weight:
440.5781
IUPAC Name:
N,N'-bis(anthracen-9-ylmethyl)ethane-1,2-diamine
InChI:
InChI=1S/C32H28N2/c1-5-13-27-23(9-1)19-24-10-2-6-14-28(24)31(27)21-33-17-18-34-22-32-29-15-7-3-11-25(29)20-26-12-4-8-16-30(26)32/h1-16,19-20,33-34H,17-18,21-22H2
InChI Key:
KVHGBDVBRUBXPY-UHFFFAOYSA-N
SMILES:
C(NCc1c2ccccc2cc2c1cccc2)CNCc1c2ccccc2cc2c1cccc2
Properties
Complexity:
535
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
440.225g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
440.59g/mol
Monoisotopic Mass:
440.225g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.4
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