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72987-36-1 | 1,3,5-Triazine-2,4-diamine,6,6'-(1-ethyl-1,2-ethanediyl)bis-
CAS No: 72987-36-1 Catalog No: AG005CZ0 MDL No:
Product Description
Catalog Number:
AG005CZ0
Chemical Name:
1,3,5-Triazine-2,4-diamine,6,6'-(1-ethyl-1,2-ethanediyl)bis-
CAS Number:
72987-36-1
Molecular Formula:
C10H16N10
Molecular Weight:
276.3010
IUPAC Name:
6-[2-(4,6-diamino-1,3,5-triazin-2-yl)butyl]-1,3,5-triazine-2,4-diamine
InChI:
InChI=1S/C10H16N10/c1-2-4(6-17-9(13)20-10(14)18-6)3-5-15-7(11)19-8(12)16-5/h4H,2-3H2,1H3,(H4,11,12,15,16,19)(H4,13,14,17,18,20)
InChI Key:
VCRJKOQZRVOZDA-UHFFFAOYSA-N
SMILES:
CCC(c1nc(N)nc(n1)N)Cc1nc(N)nc(n1)N
EC Number:
277-183-0
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.156g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
276.308g/mol
Monoisotopic Mass:
276.156g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
181A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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