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827601-89-8 | 1,5-Pentanediamine, N-(6-chloro-1,2,3,4-tetrahydro-9-acridinyl)-
CAS No: 827601-89-8 Catalog No: AG004YT7 MDL No:
Product Description
Catalog Number:
AG004YT7
Chemical Name:
1,5-Pentanediamine, N-(6-chloro-1,2,3,4-tetrahydro-9-acridinyl)-
CAS Number:
827601-89-8
Molecular Formula:
C18H24ClN3
Molecular Weight:
317.8563
IUPAC Name:
N'-(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)pentane-1,5-diamine
InChI:
InChI=1S/C18H24ClN3/c19-13-8-9-15-17(12-13)22-16-7-3-2-6-14(16)18(15)21-11-5-1-4-10-20/h8-9,12H,1-7,10-11,20H2,(H,21,22)
InChI Key:
NQBUHPRIALYKMD-UHFFFAOYSA-N
SMILES:
NCCCCCNc1c2CCCCc2nc2c1ccc(c2)Cl
Properties
Complexity:
338
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.166g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
317.861g/mol
Monoisotopic Mass:
317.166g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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