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1-(3-chlorophenyl)-4,4,4-trifluoro-3-(trifluoromethyl)butane-1,3-diol

1-(3-chlorophenyl)-4,4,4-trifluoro-3-(trifluoromethyl)butane-1,3-diol structure

CAS No:
34848-22-1
Formula:
C11H9ClF6O2
Chemical Name:
1-(3-chlorophenyl)-4,4,4-trifluoro-3-(trifluoromethyl)butane-1,3-diol
Synonyms:
34848-22-1;1,3-BUTANEDIOL, 1-(m-CHLOROPHENYL)-4,4,4-TRIFLUORO-3-TRIFLUOROMETHYL-;NSC 162056;BRN 2294572;NSC162056;alpha-((2-Hydroxy-3,3,3-trifluoro-2-trifluoromethyl)-propyl)-m-chlorobenzyl alcohol;Benzyl alcohol, m-chloro-alpha-(2-hydroxy-3,3,3-trifluoro-2-trifluoromethylpropyl)-;m-Chloro-alpha-(2-hydroxy-3,3,3-trifluoro-2-trifluoromethylpropyl)benzyl alcohol;NSC-162056;1-(m-Chlorophenyl)-4,4,4-trifluoro-3-trifluoromethyl-1,3-butanediol

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1-(3-chlorophenyl)-4,4,4-trifluoro-3-(trifluoromethyl)butane-1,3-diol Basic Attributes

Molecular Weight：

322.63 g/mol

Exact Mass：

322.0195262 g/mol

NSC Number：

162056

Characteristics

PSA：

40.5 Å²

Computed Properties

Molecular Weight:322.63
XLogP3:3.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:3
Exact Mass:322.0195262
Monoisotopic Mass:322.0195262
Topological Polar Surface Area:40.5
Heavy Atom Count:20
Complexity:316
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(3-chlorophenyl)-4,4,4-trifluoro-3-(trifluoromethyl)butane-1,3-diol

Basic Attributes
Characteristics
Computed Properties

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