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13055-88-4 | 1-Piperazinamine, N-9H-fluoren-9-ylidene-4-(9H-xanthen-9-yl)-
CAS No: 13055-88-4 Catalog No: AG000UMR MDL No:
Product Description
Catalog Number:
AG000UMR
Chemical Name:
1-Piperazinamine, N-9H-fluoren-9-ylidene-4-(9H-xanthen-9-yl)-
CAS Number:
13055-88-4
Molecular Formula:
C30H25N3O
Molecular Weight:
443.5390
IUPAC Name:
N-[4-(9H-xanthen-9-yl)piperazin-1-yl]fluoren-9-imine
InChI:
InChI=1S/C30H25N3O/c1-3-11-23-21(9-1)22-10-2-4-12-24(22)29(23)31-33-19-17-32(18-20-33)30-25-13-5-7-15-27(25)34-28-16-8-6-14-26(28)30/h1-16,30H,17-20H2
InChI Key:
GOKWJHSZKMXGTB-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)C(N1CCN(CC1)N=C1c3ccccc3c3c1cccc3)c1c(O2)cccc1
UNII:
A8M8GIU59I
Properties
Complexity:
699
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
443.2g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
443.55g/mol
Monoisotopic Mass:
443.2g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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