1-((4'-Chloro-5,5-dimethyl-3,4,5,6-tetrahydro-[1,1'-biphenyl]-2-yl)methyl)piperazine


Chemical Name: 1-((4'-Chloro-5,5-dimethyl-3,4,5,6-tetrahydro-[1,1'-biphenyl]-2-yl)methyl)piperazine
CAS Number: 1228780-72-0
Product Number: AG000JND(AGN-PC-0WAMEC)
Synonyms:
MDL No: MFCD28129720
Molecular Formula: C19H27ClN2
Molecular Weight: 318.8841

Identification/Properties


Computed Properties
Molecular Weight:
318.889g/mol
XLogP3:
3.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
318.186g/mol
Monoisotopic Mass:
318.186g/mol
Topological Polar Surface Area:
15.3A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
402
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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