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2-METHOXY-6-(2,2,2-TRIFLUOROETHOXY)BENZONITRILE

2-METHOXY-6-(2,2,2-TRIFLUOROETHOXY)BENZONITRILE structure

CAS No:
175204-03-2
Formula:
C10H8F3NO2
Chemical Name:
2-METHOXY-6-(2,2,2-TRIFLUOROETHOXY)BENZONITRILE
Synonyms:
HMS557A05;

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2-METHOXY-6-(2,2,2-TRIFLUOROETHOXY)BENZONITRILE Basic Attributes

Molecular Weight：

231.17100

Exact Mass：

231.05071298

DSSTox ID：

DTXSID70379497

HScode：

2926909090

Characteristics

PSA：

42.25000

XLogP3：

2.50798

Melting Point：

89ºC

Safety Information

Transport codes：

UN 3439

safety instructions：

S26-S36-S37-S39

Computed Properties

Molecular Weight:231.17
XLogP3:2.7
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:231.05071298
Monoisotopic Mass:231.05071298
Topological Polar Surface Area:42.2
Heavy Atom Count:16
Complexity:271
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-METHOXY-6-(2,2,2-TRIFLUOROETHOXY)BENZONITRILE

Basic Attributes
Characteristics
Safety Information
Computed Properties

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