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Home > Encyclopedia > 3-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]PROP-2-YN-1-OL

3-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]PROP-2-YN-1-OL

3-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]PROP-2-YN-1-OL structure

3-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]PROP-2-YN-1-OL 

structure
  • CAS No:

    81613-61-8

  • Formula:

    C11H6F6O

  • Chemical Name:

    3-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]PROP-2-YN-1-OL

  • Synonyms:

    3-[3,5-bis(trifluoromethyl)phenyl]prop-2-yn-1-ol;3-(3,5-Bis(trifluoromethyl)phenyl)prop-2-yn-1-ol;3-[3,5-bis(trifluoromethyl)phenyl]-prop-2-yn-1-ol;3-[3,5-bis(trifluoromethyl)phenyl]-2-propyn-1-ol;3-[3,5-bis(trifluoromethyl)phenyl]-2-propyne-1-ol;SCHEMBL80806;C11H6F6O;CTK5E8946;DTXSID80371184;KS-00003SV6

3-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]PROP-2-YN-1-OL Basic Attributes

268.16

268.032288

DTXSID80371184

2906299090

Characteristics

20.2

3.75

1.5±0.1 g/cm3

58 °C

84 °C

99.4±27.3 °C

1.458

Safety Information

36/37/38

26-36/37/39

Xi

Irritant

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501

H302

Computed Properties

Molecular Weight:268.15
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:1
Exact Mass:268.03228378
Monoisotopic Mass:268.03228378
Topological Polar Surface Area:20.2
Heavy Atom Count:18
Complexity:322
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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