[4-(difluoromethyl)phenyl]-(4-ethylphenyl)methanol

C16H16F2O — CID 115524847

IUPAC[4-(difluoromethyl)phenyl]-(4-ethylphenyl)methanol
SMILESCCc1ccc(C(O)c2ccc(C(F)F)cc2)cc1
InChIInChI=1S/C16H16F2O/c1-2-11-3-5-12(6-4-11)15(19)13-7-9-14(10-8-13)16(17)18/h3-10,15-16,19H,2H2,1H3
InChIKeyKZPGXJDZNKSTRR-UHFFFAOYSA-N
MW262.30 g/mol
LogP4.27
Rot. Bonds4

About [4-(difluoromethyl)phenyl]-(4-ethylphenyl)methanol

[4-(difluoromethyl)phenyl]-(4-ethylphenyl)methanol (PubChem CID 115524847) has the molecular formula C16H16F2O and a molecular weight of 262.30 g/mol. Its IUPAC name is [4-(difluoromethyl)phenyl]-(4-ethylphenyl)methanol.

Molecular Properties

Compound Name[4-(difluoromethyl)phenyl]-(4-ethylphenyl)methanol
PubChem CID115524847
Molecular FormulaC16H16F2O
Molecular Weight262.30 g/mol
Exact Mass262.12
IUPAC Name[4-(difluoromethyl)phenyl]-(4-ethylphenyl)methanol
SMILESCCc1ccc(C(O)c2ccc(C(F)F)cc2)cc1
InChIInChI=1S/C16H16F2O/c1-2-11-3-5-12(6-4-11)15(19)13-7-9-14(10-8-13)16(17)18/h3-10,15-16,19H,2H2,1H3
InChIKeyKZPGXJDZNKSTRR-UHFFFAOYSA-N
XLogP4.27
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.30
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [4-(difluoromethyl)phenyl]-(4-ethylphenyl)methanol?
The IUPAC name of [4-(difluoromethyl)phenyl]-(4-ethylphenyl)methanol (CID 115524847) is [4-(difluoromethyl)phenyl]-(4-ethylphenyl)methanol.
What is the SMILES notation for [4-(difluoromethyl)phenyl]-(4-ethylphenyl)methanol?
The canonical SMILES for [4-(difluoromethyl)phenyl]-(4-ethylphenyl)methanol is CCc1ccc(C(O)c2ccc(C(F)F)cc2)cc1.
What is the InChIKey of [4-(difluoromethyl)phenyl]-(4-ethylphenyl)methanol?
The InChIKey is KZPGXJDZNKSTRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F2O/c1-2-11-3-5-12(6-4-11)15(19)13-7-9-14(10-8-13)16(17)18/h3-10,15-16,19H,2H2,1H3.
What are the key properties of [4-(difluoromethyl)phenyl]-(4-ethylphenyl)methanol?
[4-(difluoromethyl)phenyl]-(4-ethylphenyl)methanol has a molecular weight of 262.30 g/mol, XLogP of 4.27, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(difluoromethyl)phenyl]-(4-ethylphenyl)methanol is sourced from PubChem (CID 115524847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).