(Z)-2-fluoro-1,3-bis(4-phenylphenyl)prop-2-en-1-ol

C27H21FO — CID 15461019

IUPAC(Z)-2-fluoro-1,3-bis(4-phenylphenyl)prop-2-en-1-ol
SMILESOC(/C(F)=C/c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C27H21FO/c28-26(19-20-11-13-23(14-12-20)21-7-3-1-4-8-21)27(29)25-17-15-24(16-18-25)22-9-5-2-6-10-22/h1-19,27,29H/b26-19-
InChIKeyUBULAEIPBZGAHD-XHPQRKPJSA-N
MW380.46 g/mol
LogP7.06
Rot. Bonds5

About (Z)-2-fluoro-1,3-bis(4-phenylphenyl)prop-2-en-1-ol

(Z)-2-fluoro-1,3-bis(4-phenylphenyl)prop-2-en-1-ol (PubChem CID 15461019) has the molecular formula C27H21FO and a molecular weight of 380.46 g/mol. Its IUPAC name is (Z)-2-fluoro-1,3-bis(4-phenylphenyl)prop-2-en-1-ol.

Molecular Properties

Compound Name(Z)-2-fluoro-1,3-bis(4-phenylphenyl)prop-2-en-1-ol
PubChem CID15461019
Molecular FormulaC27H21FO
Molecular Weight380.46 g/mol
Exact Mass380.16
IUPAC Name(Z)-2-fluoro-1,3-bis(4-phenylphenyl)prop-2-en-1-ol
SMILESOC(/C(F)=C/c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C27H21FO/c28-26(19-20-11-13-23(14-12-20)21-7-3-1-4-8-21)27(29)25-17-15-24(16-18-25)22-9-5-2-6-10-22/h1-19,27,29H/b26-19-
InChIKeyUBULAEIPBZGAHD-XHPQRKPJSA-N
XLogP7.06
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms29
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.46
LogP ≤ 57.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-fluoro-1,3-bis(4-phenylphenyl)prop-2-en-1-ol?
The IUPAC name of (Z)-2-fluoro-1,3-bis(4-phenylphenyl)prop-2-en-1-ol (CID 15461019) is (Z)-2-fluoro-1,3-bis(4-phenylphenyl)prop-2-en-1-ol.
What is the SMILES notation for (Z)-2-fluoro-1,3-bis(4-phenylphenyl)prop-2-en-1-ol?
The canonical SMILES for (Z)-2-fluoro-1,3-bis(4-phenylphenyl)prop-2-en-1-ol is OC(/C(F)=C/c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of (Z)-2-fluoro-1,3-bis(4-phenylphenyl)prop-2-en-1-ol?
The InChIKey is UBULAEIPBZGAHD-XHPQRKPJSA-N. The full InChI is InChI=1S/C27H21FO/c28-26(19-20-11-13-23(14-12-20)21-7-3-1-4-8-21)27(29)25-17-15-24(16-18-25)22-9-5-2-6-10-22/h1-19,27,29H/b26-19-.
What are the key properties of (Z)-2-fluoro-1,3-bis(4-phenylphenyl)prop-2-en-1-ol?
(Z)-2-fluoro-1,3-bis(4-phenylphenyl)prop-2-en-1-ol has a molecular weight of 380.46 g/mol, XLogP of 7.06, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-fluoro-1,3-bis(4-phenylphenyl)prop-2-en-1-ol is sourced from PubChem (CID 15461019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).