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177489-10-0 | Phenol, 3-(4-methyl-1-piperazinyl)-
CAS No: 177489-10-0 Catalog No: AG0025CL MDL No:
Product Description
Catalog Number:
AG0025CL
Chemical Name:
Phenol, 3-(4-methyl-1-piperazinyl)-
CAS Number:
177489-10-0
Molecular Formula:
C11H16N2O
Molecular Weight:
192.2575
IUPAC Name:
3-(4-methylpiperazin-1-yl)phenol
InChI:
InChI=1S/C11H16N2O/c1-12-5-7-13(8-6-12)10-3-2-4-11(14)9-10/h2-4,9,14H,5-8H2,1H3
InChI Key:
AISHPJPGKBKMGV-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)c1cccc(c1)O
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.126g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.262g/mol
Monoisotopic Mass:
192.126g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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