2,3,5,6-Tetrafluoro-1,4-benzenedimethanol - CAS 92339-07-6
Catalog: |
BB040492 |
Product Name: |
2,3,5,6-Tetrafluoro-1,4-benzenedimethanol |
CAS: |
92339-07-6 |
Synonyms: |
[2,3,5,6-tetrafluoro-4-(hydroxymethyl)phenyl]methanol; [2,3,5,6-tetrafluoro-4-(hydroxymethyl)phenyl]methanol |
IUPAC Name: | [2,3,5,6-tetrafluoro-4-(hydroxymethyl)phenyl]methanol |
Description: | 2,3,5,6-Tetrafluoro-1,4-benzenedimethanol (CAS# 92339-07-6) is a useful research chemical. |
Molecular Weight: | 210.13 |
Molecular Formula: | C8H6F4O2 |
Canonical SMILES: | C(C1=C(C(=C(C(=C1F)F)CO)F)F)O |
InChI: | InChI=1S/C8H6F4O2/c9-5-3(1-13)6(10)8(12)4(2-14)7(5)11/h13-14H,1-2H2 |
InChI Key: | SDHKGYDQOGCLQM-UHFFFAOYSA-N |
Boiling Point: | 256.0±35.0 °C (Predicted) |
Melting Point: | 127.0 to 131.0 °C |
Purity: | > 97.0 % (GC) |
Density: | 1.569±0.06 g/cm3(Predicted) |
Appearance: | White to almost white powder to crystal |
MDL: | MFCD00229147 |
LogP: | 1.22760 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501 |
Signal Word: | Warning |
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Complexity: | 156 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 210.03039208 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 210.03039208 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 40.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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