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85154-22-9 | 3,6,9,12-Tetraazatetradecane-1,14-diamine,trimethyl- (9CI)
CAS No: 85154-22-9 Catalog No: AG004WSC MDL No:
Product Description
Catalog Number:
AG004WSC
Chemical Name:
3,6,9,12-Tetraazatetradecane-1,14-diamine,trimethyl- (9CI)
CAS Number:
85154-22-9
Molecular Formula:
C13H34N6
Molecular Weight:
274.4493
IUPAC Name:
3-N-[2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]ethyl]-2-methylbutane-2,3-diamine
InChI:
InChI=1S/C13H34N6/c1-12(13(2,3)15)19-11-10-18-9-8-17-7-6-16-5-4-14/h12,16-19H,4-11,14-15H2,1-3H3
InChI Key:
KWWCPGKBUVGQAH-UHFFFAOYSA-N
SMILES:
NCCNCCNCCNCCNC(C(N)(C)C)C
EC Number:
285-904-5
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.284g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
274.457g/mol
Monoisotopic Mass:
274.284g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.3
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