1H-Imidazole, 4-[(1S)-1-(2,3-dimethylphenyl)ethyl]-


Chemical Name: 1H-Imidazole, 4-[(1S)-1-(2,3-dimethylphenyl)ethyl]-
CAS Number: 113775-47-6
Product Number: AG0009NM(AGN-PC-0NYADR)
Synonyms:
MDL No:
Molecular Formula: C13H16N2
Molecular Weight: 200.2795

Identification/Properties


Computed Properties
Molecular Weight:
200.285g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
2
Exact Mass:
200.131g/mol
Monoisotopic Mass:
200.131g/mol
Topological Polar Surface Area:
28.7A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
205
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
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#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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