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

C16H14F2O — CID 102212500

IUPAC(Z)-4,4-difluoro-1,3-diphenylbut-2-en-1-ol
SMILESOC(/C=C(/c1ccccc1)C(F)F)c1ccccc1
InChIInChI=1S/C16H14F2O/c17-16(18)14(12-7-3-1-4-8-12)11-15(19)13-9-5-2-6-10-13/h1-11,15-16,19H/b14-11-
InChIKeyRHCGPQUXQZTOFF-KAMYIIQDSA-N
MW260.28 g/mol
LogP4.07
Rot. Bonds4

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

(Z)-4,4-difluoro-1,3-diphenylbut-2-en-1-ol (PubChem CID 102212500) has the molecular formula C16H14F2O and a molecular weight of 260.28 g/mol. Its IUPAC name is (Z)-4,4-difluoro-1,3-diphenylbut-2-en-1-ol.

Molecular Properties

Compound Name(Z)-4,4-difluoro-1,3-diphenylbut-2-en-1-ol
PubChem CID102212500
Molecular FormulaC16H14F2O
Molecular Weight260.28 g/mol
Exact Mass260.10
IUPAC Name(Z)-4,4-difluoro-1,3-diphenylbut-2-en-1-ol
SMILESOC(/C=C(/c1ccccc1)C(F)F)c1ccccc1
InChIInChI=1S/C16H14F2O/c17-16(18)14(12-7-3-1-4-8-12)11-15(19)13-9-5-2-6-10-13/h1-11,15-16,19H/b14-11-
InChIKeyRHCGPQUXQZTOFF-KAMYIIQDSA-N
XLogP4.07
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.28
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(Z)-4,4,4-trifluoro-1,3-diphenylbut-2-en-1-ol
CID 15517209
(Z)-1,4-diphenylbut-2-ene-1,4-diol
CID 12815414
(E,1R)-1,2-diphenylbut-2-en-1-ol
CID 135000774
CID 135030986
CID 135030986
(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
4-[(Z)-1,2-diphenylbut-2-enyl]phenol
CID 70549911
(1R)-2,2-difluoro-1-phenylethanol
CID 12955760
(E,2S)-3,4-diphenylbut-3-en-2-ol
CID 177489258
1,2-diphenylprop-2-en-1-ol
CID 11586526

Frequently Asked Questions

What is the IUPAC name of (Z)-4,4-difluoro-1,3-diphenylbut-2-en-1-ol?
The IUPAC name of (Z)-4,4-difluoro-1,3-diphenylbut-2-en-1-ol (CID 102212500) is (Z)-4,4-difluoro-1,3-diphenylbut-2-en-1-ol.
What is the SMILES notation for (Z)-4,4-difluoro-1,3-diphenylbut-2-en-1-ol?
The canonical SMILES for (Z)-4,4-difluoro-1,3-diphenylbut-2-en-1-ol is OC(/C=C(/c1ccccc1)C(F)F)c1ccccc1.
What is the InChIKey of (Z)-4,4-difluoro-1,3-diphenylbut-2-en-1-ol?
The InChIKey is RHCGPQUXQZTOFF-KAMYIIQDSA-N. The full InChI is InChI=1S/C16H14F2O/c17-16(18)14(12-7-3-1-4-8-12)11-15(19)13-9-5-2-6-10-13/h1-11,15-16,19H/b14-11-.
What are the key properties of (Z)-4,4-difluoro-1,3-diphenylbut-2-en-1-ol?
(Z)-4,4-difluoro-1,3-diphenylbut-2-en-1-ol has a molecular weight of 260.28 g/mol, XLogP of 4.07, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4,4-difluoro-1,3-diphenylbut-2-en-1-ol is sourced from PubChem (CID 102212500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).