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869946-18-9 | 2-[4-(2-Amino-phenyl)-piperazin-1-yl]-ethanol
CAS No: 869946-18-9 Catalog No: AG004KE8 MDL No:MFCD04971044
Product Description
Catalog Number:
AG004KE8
Chemical Name:
2-[4-(2-Amino-phenyl)-piperazin-1-yl]-ethanol
CAS Number:
869946-18-9
Molecular Formula:
C12H19N3O
Molecular Weight:
221.2988
MDL Number:
MFCD04971044
IUPAC Name:
2-[4-(2-aminophenyl)piperazin-1-yl]ethanol
InChI:
InChI=1S/C12H19N3O/c13-11-3-1-2-4-12(11)15-7-5-14(6-8-15)9-10-16/h1-4,16H,5-10,13H2
InChI Key:
YZRHRBADADYIFX-UHFFFAOYSA-N
SMILES:
OCCN1CCN(CC1)c1ccccc1N
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.153g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
221.304g/mol
Monoisotopic Mass:
221.153g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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