Benzenemethanamine, 3,5-bis(trifluoromethyl)-


Chemical Name: Benzenemethanamine, 3,5-bis(trifluoromethyl)-
CAS Number: 85068-29-7
Product Number: AG003IK5(AGN-PC-0JS9UM)
Synonyms:
MDL No:
Molecular Formula: C9H7F6N
Molecular Weight: 243.1490

Identification/Properties


Properties
MP:
50-55 °C(lit.)
BP:
165.5 °C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
243.152g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
1
Exact Mass:
243.048g/mol
Monoisotopic Mass:
243.048g/mol
Topological Polar Surface Area:
26A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
211
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:
Danger
UN#:
3259
Hazard Statements:
H314
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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