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116387-68-9 | 5H-Benzo[a]phenoxazin-9-amine, N,N-diethyl-
CAS No: 116387-68-9 Catalog No: AG000CE1 MDL No:
Product Description
Catalog Number:
AG000CE1
Chemical Name:
5H-Benzo[a]phenoxazin-9-amine, N,N-diethyl-
CAS Number:
116387-68-9
Molecular Formula:
C20H20N2O
Molecular Weight:
304.3856
IUPAC Name:
N,N-diethyl-5H-benzo[a]phenoxazin-9-amine
InChI:
InChI=1S/C20H20N2O/c1-3-22(4-2)15-10-11-17-19(13-15)23-18-12-9-14-7-5-6-8-16(14)20(18)21-17/h5-8,10-13H,3-4,9H2,1-2H3
InChI Key:
LQHNQNWFFPXPAU-UHFFFAOYSA-N
SMILES:
CCN(c1ccc2c(c1)OC1=CCc3c(C1=N2)cccc3)CC
Properties
Complexity:
494
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.158g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
304.393g/mol
Monoisotopic Mass:
304.158g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
24.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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