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143715-88-2 | 1,3-Propanediamine, N1,N1-dimethyl-N3-(3-nitro-9(10H)-acridinylidene)-
CAS No: 143715-88-2 Catalog No: AG001I9E MDL No:
Product Description
Catalog Number:
AG001I9E
Chemical Name:
1,3-Propanediamine, N1,N1-dimethyl-N3-(3-nitro-9(10H)-acridinylidene)-
CAS Number:
143715-88-2
Molecular Formula:
C18H20N4O2
Molecular Weight:
324.3770
IUPAC Name:
N',N'-dimethyl-N-(3-nitroacridin-9-yl)propane-1,3-diamine
InChI:
InChI=1S/C18H20N4O2/c1-21(2)11-5-10-19-18-14-6-3-4-7-16(14)20-17-12-13(22(23)24)8-9-15(17)18/h3-4,6-9,12H,5,10-11H2,1-2H3,(H,19,20)
InChI Key:
BOBCFIQLKNNHRJ-UHFFFAOYSA-N
SMILES:
CN(CCCN=c1c2ccccc2[nH]c2c1ccc(c2)[N+](=O)[O-])C
Properties
Complexity:
426
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.159g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
324.384g/mol
Monoisotopic Mass:
324.159g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
74A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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