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138145-64-9 | 1,2-Ethanediamine, N,N-bis(2-aminoethyl)-, triperchlorate (9CI)
CAS No: 138145-64-9 Catalog No: AG001820 MDL No:
Product Description
Catalog Number:
AG001820
Chemical Name:
1,2-Ethanediamine, N,N-bis(2-aminoethyl)-, triperchlorate (9CI)
CAS Number:
138145-64-9
Molecular Formula:
C6H21Cl3N4O12
Molecular Weight:
447.6095
IUPAC Name:
N',N'-bis(2-aminoethyl)ethane-1,2-diamine;perchloric acid
InChI:
InChI=1S/C6H18N4.3ClHO4/c7-1-4-10(5-2-8)6-3-9;3*2-1(3,4)5/h1-9H2;3*(H,2,3,4,5)
InChI Key:
NLGXAYBVGOAKPA-UHFFFAOYSA-N
SMILES:
O[Cl](=O)(=O)=O.O[Cl](=O)(=O)=O.O[Cl](=O)(=O)=O.NCCN(CCN)CCN
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
4
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
446.022g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
16
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
447.6g/mol
Monoisotopic Mass:
446.022g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
296A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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