Benzeneacetonitrile, 4-(difluoromethoxy)-


Chemical Name: Benzeneacetonitrile, 4-(difluoromethoxy)-
CAS Number: 41429-16-7
Product Number: AG00C0JC(AGN-PC-0KK88C)
Synonyms:
MDL No:
Molecular Formula: C9H7F2NO
Molecular Weight: 183.1548

Identification/Properties


Properties
BP:
262.4°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Computed Properties
Molecular Weight:
183.158g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
183.05g/mol
Monoisotopic Mass:
183.05g/mol
Topological Polar Surface Area:
33A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
191
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-H312-H319-H332
Precautionary Statements:
P280-P310-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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