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87007-99-6 | Benzenamine, 2-[2-[4-(2-methylphenyl)-1-piperazinyl]ethyl]-
CAS No: 87007-99-6 Catalog No: AG004GR4 MDL No:
Product Description
Catalog Number:
AG004GR4
Chemical Name:
Benzenamine, 2-[2-[4-(2-methylphenyl)-1-piperazinyl]ethyl]-
CAS Number:
87007-99-6
Molecular Formula:
C19H25N3
Molecular Weight:
295.4219
IUPAC Name:
2-[2-[4-(2-methylphenyl)piperazin-1-yl]ethyl]aniline
InChI:
InChI=1S/C19H25N3/c1-16-6-2-5-9-19(16)22-14-12-21(13-15-22)11-10-17-7-3-4-8-18(17)20/h2-9H,10-15,20H2,1H3
InChI Key:
WPOZDEAUSCPSGF-UHFFFAOYSA-N
SMILES:
Cc1ccccc1N1CCN(CC1)CCc1ccccc1N
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.205g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
295.43g/mol
Monoisotopic Mass:
295.205g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
32.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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