Benzonitrile, 2-methoxy-5-(trifluoromethyl)-


Chemical Name: Benzonitrile, 2-methoxy-5-(trifluoromethyl)-
CAS Number: 34636-92-5
Product Number: AG003HJ6(AGN-PC-01LRGQ)
Synonyms:
MDL No: MFCD06409082
Molecular Formula: C9H6F3NO
Molecular Weight: 201.1452

Identification/Properties


Properties
MP:
30-34℃
BP:
256.8°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
201.148g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
201.04g/mol
Monoisotopic Mass:
201.04g/mol
Topological Polar Surface Area:
33A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
242
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#:
3439
Hazard Statements:
H302+H312-H315-H319-H331-H335
Precautionary Statements:
P261-P280-P305+P351+P338-P311
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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