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672325-37-0 | 1-[3-(4-Methylpiperazin-1-yl)phenyl]methanamine
CAS No: 672325-37-0 Catalog No: AG003DT6 MDL No:MFCD07368540
Product Description
Catalog Number:
AG003DT6
Chemical Name:
1-[3-(4-Methylpiperazin-1-yl)phenyl]methanamine
CAS Number:
672325-37-0
Molecular Formula:
C12H19N3
Molecular Weight:
205.2994
MDL Number:
MFCD07368540
IUPAC Name:
[3-(4-methylpiperazin-1-yl)phenyl]methanamine
InChI:
InChI=1S/C12H19N3/c1-14-5-7-15(8-6-14)12-4-2-3-11(9-12)10-13/h2-4,9H,5-8,10,13H2,1H3
InChI Key:
VKTLTRIKVYJVOX-UHFFFAOYSA-N
SMILES:
NCc1cccc(c1)N1CCN(CC1)C
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.158g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.305g/mol
Monoisotopic Mass:
205.158g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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