(Z)-4,4,4-trifluoro-1,3-diphenylbut-2-en-1-ol

C16H13F3O — CID 15517209

IUPAC(Z)-4,4,4-trifluoro-1,3-diphenylbut-2-en-1-ol
SMILESOC(/C=C(/c1ccccc1)C(F)(F)F)c1ccccc1
InChIInChI=1S/C16H13F3O/c17-16(18,19)14(12-7-3-1-4-8-12)11-15(20)13-9-5-2-6-10-13/h1-11,15,20H/b14-11-
InChIKeyYWYFULAKMOHPST-KAMYIIQDSA-N
MW278.27 g/mol
LogP4.37
Rot. Bonds3

About (Z)-4,4,4-trifluoro-1,3-diphenylbut-2-en-1-ol

(Z)-4,4,4-trifluoro-1,3-diphenylbut-2-en-1-ol (PubChem CID 15517209) has the molecular formula C16H13F3O and a molecular weight of 278.27 g/mol. Its IUPAC name is (Z)-4,4,4-trifluoro-1,3-diphenylbut-2-en-1-ol.

Molecular Properties

Compound Name(Z)-4,4,4-trifluoro-1,3-diphenylbut-2-en-1-ol
PubChem CID15517209
Molecular FormulaC16H13F3O
Molecular Weight278.27 g/mol
Exact Mass278.09
IUPAC Name(Z)-4,4,4-trifluoro-1,3-diphenylbut-2-en-1-ol
SMILESOC(/C=C(/c1ccccc1)C(F)(F)F)c1ccccc1
InChIInChI=1S/C16H13F3O/c17-16(18,19)14(12-7-3-1-4-8-12)11-15(20)13-9-5-2-6-10-13/h1-11,15,20H/b14-11-
InChIKeyYWYFULAKMOHPST-KAMYIIQDSA-N
XLogP4.37
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.27
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(Z)-4,4,4-trifluoro-3-(4-methoxyphenyl)-1-phenylbut-2-en-1-ol
CID 177392533
(Z)-4,4-difluoro-1,3-diphenylbut-2-en-1-ol
CID 102212500
(Z)-1,4-diphenylbut-2-ene-1,4-diol
CID 12815414
(2E)-7-methyl-1-phenyl-3-(trifluoromethyl)octa-2,6-dien-1-ol
CID 102103946
[(E)-1,1,1-trifluoro-4-phenylbut-2-en-2-yl]benzene
CID 175788852
CID 135030986
CID 135030986
(1S)-2,2,2-trifluoro-1-phenylethanol
CID 1472401
(2S)-2-hydroxy-2-phenylacetaldehyde
CID 12536674
benzene;1-phenylprop-2-en-1-ol
CID 174884403
(E)-1,3-diphenyl-4-pyrrolidin-1-ylbut-2-en-1-ol
CID 91991271
(1S)-1,2,2-triphenylethanol
CID 38988933
1,1,1-trifluoro-4-phenylpent-3-en-2-ol
CID 54050164

Frequently Asked Questions

What is the IUPAC name of (Z)-4,4,4-trifluoro-1,3-diphenylbut-2-en-1-ol?
The IUPAC name of (Z)-4,4,4-trifluoro-1,3-diphenylbut-2-en-1-ol (CID 15517209) is (Z)-4,4,4-trifluoro-1,3-diphenylbut-2-en-1-ol.
What is the SMILES notation for (Z)-4,4,4-trifluoro-1,3-diphenylbut-2-en-1-ol?
The canonical SMILES for (Z)-4,4,4-trifluoro-1,3-diphenylbut-2-en-1-ol is OC(/C=C(/c1ccccc1)C(F)(F)F)c1ccccc1.
What is the InChIKey of (Z)-4,4,4-trifluoro-1,3-diphenylbut-2-en-1-ol?
The InChIKey is YWYFULAKMOHPST-KAMYIIQDSA-N. The full InChI is InChI=1S/C16H13F3O/c17-16(18,19)14(12-7-3-1-4-8-12)11-15(20)13-9-5-2-6-10-13/h1-11,15,20H/b14-11-.
What are the key properties of (Z)-4,4,4-trifluoro-1,3-diphenylbut-2-en-1-ol?
(Z)-4,4,4-trifluoro-1,3-diphenylbut-2-en-1-ol has a molecular weight of 278.27 g/mol, XLogP of 4.37, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4,4,4-trifluoro-1,3-diphenylbut-2-en-1-ol is sourced from PubChem (CID 15517209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).