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1-(benzotriazol-1-yl)-2,2,2-trifluoroethanone

1-(benzotriazol-1-yl)-2,2,2-trifluoroethanone structure

CAS No:
183266-61-7
Formula:
C8H4F3N3O
Chemical Name:
1-(benzotriazol-1-yl)-2,2,2-trifluoroethanone
Synonyms:
1-(trifluoroacetyl)-1H-benzotriazole; 1h-benzotriazole,1-(trifluoroacetyl); 1-(trifluoroacetyl)benzotriazole; TFABI; 1-(Trifluoromethyl)acetylbenzotriazole; trifluoroacetyl benzotriazole; N-Trifluoroacetylbenzotriazole;Expand

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1-(benzotriazol-1-yl)-2,2,2-trifluoroethanone Basic Attributes

Molecular Weight：

215.13200

Exact Mass：

215.03064625

DSSTox ID：

DTXSID60391764

Characteristics

PSA：

47.78000

XLogP3：

1.63380

Density：

1.58g/cm3

Melting Point：

66-70ºC(lit.)

Boiling Point：

243.8ºC at 760 mmHg

Flash Point：

101.3ºC

Refractive Index：

1.581

Vapor Pressure：

0.0314mmHg at 25°C

Safety Information

wgk germany：

Computed Properties

Molecular Weight:215.13
XLogP3:2.1
Hydrogen Bond Acceptor Count:6
Exact Mass:215.03064625
Monoisotopic Mass:215.03064625
Topological Polar Surface Area:47.8
Heavy Atom Count:15
Complexity:268
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(benzotriazol-1-yl)-2,2,2-trifluoroethanone

Basic Attributes
Characteristics
Safety Information
Computed Properties

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