Benzonitrile, 2,4-bis(trifluoromethyl)-


Chemical Name: Benzonitrile, 2,4-bis(trifluoromethyl)-
CAS Number: 177952-38-4
Product Number: AG0025NL(AGN-PC-0KK7L6)
Synonyms:
MDL No:
Molecular Formula: C9H3F6N
Molecular Weight: 239.1172

Identification/Properties


Properties
BP:
195.8°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
239.12g/mol
XLogP3:
3.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
0
Exact Mass:
239.017g/mol
Monoisotopic Mass:
239.017g/mol
Topological Polar Surface Area:
23.8A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
295
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#:
3276
Hazard Statements:
H301-H315-H319-H335
Precautionary Statements:
P233-P260-P261-P264-P270-P271-P280-P301+P310-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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