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4,4,4-trifluoro-3-(trifluoromethyl)-1-[3-(trifluoromethyl)phenyl]butane-1,3-diol

4,4,4-trifluoro-3-(trifluoromethyl)-1-[3-(trifluoromethyl)phenyl]butane-1,3-diol structure

CAS No:
34848-23-2
Formula:
C12H9F9O2
Chemical Name:
4,4,4-trifluoro-3-(trifluoromethyl)-1-[3-(trifluoromethyl)phenyl]butane-1,3-diol
Synonyms:
34848-23-2;NSC 162265;BRN 2015808;NSC162265;1,3-Butanediol, 1-(3-trifluoromethylphenyl)-3-trifluoromethyl-4,4,4-trifluoro-;1,3-Butanediol, 4,4,4-trifluoro-3-(trifluoromethyl)-1-(alpha,alpha,alpha-trifluoro-m-tolyl)-;4,4,4-Trifluoro-3-trifluoromethyl-1-(3-(alpha,alpha,alpha-trifluoro)tolyl)-1,3-butanediol;NSC-162265;4,4,4-Trifluoro-3-trifluoromethyl-1-(alpha,alpha,alpha-trifluoro-m-tolyl)-1,3-butanediol

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4,4,4-trifluoro-3-(trifluoromethyl)-1-[3-(trifluoromethyl)phenyl]butane-1,3-diol Basic Attributes

Molecular Weight：

356.18 g/mol

Exact Mass：

356.04588298 g/mol

NSC Number：

162265

Characteristics

PSA：

40.5 Å²

Computed Properties

Molecular Weight:356.18
XLogP3:3.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:3
Exact Mass:356.04588298
Monoisotopic Mass:356.04588298
Topological Polar Surface Area:40.5
Heavy Atom Count:23
Complexity:385
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4,4,4-trifluoro-3-(trifluoromethyl)-1-[3-(trifluoromethyl)phenyl]butane-1,3-diol

Basic Attributes
Characteristics
Computed Properties

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