(E)-3-[4-(4-fluorophenyl)phenyl]but-2-en-1-ol

C16H15FO — CID 58816048

IUPAC(E)-3-[4-(4-fluorophenyl)phenyl]but-2-en-1-ol
SMILESC/C(=C\CO)c1ccc(-c2ccc(F)cc2)cc1
InChIInChI=1S/C16H15FO/c1-12(10-11-18)13-2-4-14(5-3-13)15-6-8-16(17)9-7-15/h2-10,18H,11H2,1H3/b12-10+
InChIKeyOCGQUMCXLYIYSA-ZRDIBKRKSA-N
MW242.29 g/mol
LogP3.89
Rot. Bonds3

About (E)-3-[4-(4-fluorophenyl)phenyl]but-2-en-1-ol

(E)-3-[4-(4-fluorophenyl)phenyl]but-2-en-1-ol (PubChem CID 58816048) has the molecular formula C16H15FO and a molecular weight of 242.29 g/mol. Its IUPAC name is (E)-3-[4-(4-fluorophenyl)phenyl]but-2-en-1-ol.

Molecular Properties

Compound Name(E)-3-[4-(4-fluorophenyl)phenyl]but-2-en-1-ol
PubChem CID58816048
Molecular FormulaC16H15FO
Molecular Weight242.29 g/mol
Exact Mass242.11
IUPAC Name(E)-3-[4-(4-fluorophenyl)phenyl]but-2-en-1-ol
SMILESC/C(=C\CO)c1ccc(-c2ccc(F)cc2)cc1
InChIInChI=1S/C16H15FO/c1-12(10-11-18)13-2-4-14(5-3-13)15-6-8-16(17)9-7-15/h2-10,18H,11H2,1H3/b12-10+
InChIKeyOCGQUMCXLYIYSA-ZRDIBKRKSA-N
XLogP3.89
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.29
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-[4-(2,4-difluorophenyl)phenyl]but-2-en-1-ol
CID 54113945
(E)-3-[4-[3,5-bis(trifluoromethyl)phenyl]phenyl]but-2-en-1-ol
CID 20765801
3-[4-[3,5-bis(trifluoromethyl)phenyl]phenyl]but-2-en-1-ol
CID 91173371
ethane;1-fluoro-4-[(E)-pent-2-en-2-yl]benzene
CID 142869478
2-[4-[3-[4-(4-fluorophenyl)phenyl]but-2-enyl]piperazin-1-yl]ethanol
CID 54252041
(Z)-3-(4-iodophenyl)but-2-en-1-ol
CID 22557590
3,3-bis(4-fluorophenyl)prop-2-en-1-ol
CID 71352890
(Z)-3-(4-tert-butylphenyl)but-2-en-1-ol
CID 176916029
3-[4-(2,4-difluorophenoxy)phenyl]but-2-en-1-ol
CID 54201051
ethyl (E)-3-[4-(4-fluorophenyl)phenyl]but-2-enoate
CID 22557664
1-(1-bromoprop-1-en-2-yl)-4-fluorobenzene
CID 86644757
3-[4-(4-bromophenyl)phenyl]but-2-en-1-amine
CID 54185430

Frequently Asked Questions

What is the IUPAC name of (E)-3-[4-(4-fluorophenyl)phenyl]but-2-en-1-ol?
The IUPAC name of (E)-3-[4-(4-fluorophenyl)phenyl]but-2-en-1-ol (CID 58816048) is (E)-3-[4-(4-fluorophenyl)phenyl]but-2-en-1-ol.
What is the SMILES notation for (E)-3-[4-(4-fluorophenyl)phenyl]but-2-en-1-ol?
The canonical SMILES for (E)-3-[4-(4-fluorophenyl)phenyl]but-2-en-1-ol is C/C(=C\CO)c1ccc(-c2ccc(F)cc2)cc1.
What is the InChIKey of (E)-3-[4-(4-fluorophenyl)phenyl]but-2-en-1-ol?
The InChIKey is OCGQUMCXLYIYSA-ZRDIBKRKSA-N. The full InChI is InChI=1S/C16H15FO/c1-12(10-11-18)13-2-4-14(5-3-13)15-6-8-16(17)9-7-15/h2-10,18H,11H2,1H3/b12-10+.
What are the key properties of (E)-3-[4-(4-fluorophenyl)phenyl]but-2-en-1-ol?
(E)-3-[4-(4-fluorophenyl)phenyl]but-2-en-1-ol has a molecular weight of 242.29 g/mol, XLogP of 3.89, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-[4-(4-fluorophenyl)phenyl]but-2-en-1-ol is sourced from PubChem (CID 58816048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).