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89698-31-7 | Guanidine, N,N'''-1,6-hexanediylbis-, phosphate
CAS No: 89698-31-7 Catalog No: AG004391 MDL No:
Product Description
Catalog Number:
AG004391
Chemical Name:
Guanidine, N,N'''-1,6-hexanediylbis-, phosphate
CAS Number:
89698-31-7
Molecular Formula:
C8H23N6O4P
Molecular Weight:
298.2798
IUPAC Name:
2-[6-(diaminomethylideneamino)hexyl]guanidine;phosphoric acid
InChI:
InChI=1S/C8H20N6.H3O4P/c9-7(10)13-5-3-1-2-4-6-14-8(11)12;1-5(2,3)4/h1-6H2,(H4,9,10,13)(H4,11,12,14);(H3,1,2,3,4)
InChI Key:
YZORZCWKYHCBNV-UHFFFAOYSA-N
SMILES:
OP(=O)(O)O.NC(=N)NCCCCCCNC(=N)N
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.152g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
7
Isotope Atom Count:
0
Molecular Weight:
298.284g/mol
Monoisotopic Mass:
298.152g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
207A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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