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4,4,4-trifluoro-1-(3-nitrophenyl)-3-(trifluoromethyl)but-2-en-1-ol

4,4,4-trifluoro-1-(3-nitrophenyl)-3-(trifluoromethyl)but-2-en-1-ol structure

CAS No:
100482-54-0
Formula:
C11H7F6NO3
Chemical Name:
4,4,4-trifluoro-1-(3-nitrophenyl)-3-(trifluoromethyl)but-2-en-1-ol

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4,4,4-trifluoro-1-(3-nitrophenyl)-3-(trifluoromethyl)but-2-en-1-ol Basic Attributes

Molecular Weight：

315.16900

Exact Mass：

315.03301206 g/mol

NSC Number：

162145

Characteristics

PSA：

66.05000

XLogP3：

4.20240

Density：

1.514g/cm3

Boiling Point：

328.9ºC

Flash Point：

152.7ºC

Refractive Index：

1.475

Vapor Pressure：

7.42E-05mmHg at 25°C

Computed Properties

Molecular Weight:315.17
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:2
Exact Mass:315.03301206
Monoisotopic Mass:315.03301206
Topological Polar Surface Area:66
Heavy Atom Count:21
Complexity:396
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4,4,4-trifluoro-1-(3-nitrophenyl)-3-(trifluoromethyl)but-2-en-1-ol

Basic Attributes
Characteristics
Computed Properties

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