4-[1-(difluoromethyl)cyclopropyl]phenol

C10H10F2O — CID 84718814

IUPAC4-[1-(difluoromethyl)cyclopropyl]phenol
SMILESOc1ccc(C2(C(F)F)CC2)cc1
InChIInChI=1S/C10H10F2O/c11-9(12)10(5-6-10)7-1-3-8(13)4-2-7/h1-4,9,13H,5-6H2
InChIKeyFQUZTOVFOBERKT-UHFFFAOYSA-N
MW184.19 g/mol
LogP2.69
Rot. Bonds2

About 4-[1-(difluoromethyl)cyclopropyl]phenol

4-[1-(difluoromethyl)cyclopropyl]phenol (PubChem CID 84718814) has the molecular formula C10H10F2O and a molecular weight of 184.19 g/mol. Its IUPAC name is 4-[1-(difluoromethyl)cyclopropyl]phenol.

Molecular Properties

Compound Name4-[1-(difluoromethyl)cyclopropyl]phenol
PubChem CID84718814
Molecular FormulaC10H10F2O
Molecular Weight184.19 g/mol
Exact Mass184.07
IUPAC Name4-[1-(difluoromethyl)cyclopropyl]phenol
SMILESOc1ccc(C2(C(F)F)CC2)cc1
InChIInChI=1S/C10H10F2O/c11-9(12)10(5-6-10)7-1-3-8(13)4-2-7/h1-4,9,13H,5-6H2
InChIKeyFQUZTOVFOBERKT-UHFFFAOYSA-N
XLogP2.69
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.19
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-[1-(difluoromethyl)cyclopropyl]phenol?
The IUPAC name of 4-[1-(difluoromethyl)cyclopropyl]phenol (CID 84718814) is 4-[1-(difluoromethyl)cyclopropyl]phenol.
What is the SMILES notation for 4-[1-(difluoromethyl)cyclopropyl]phenol?
The canonical SMILES for 4-[1-(difluoromethyl)cyclopropyl]phenol is Oc1ccc(C2(C(F)F)CC2)cc1.
What is the InChIKey of 4-[1-(difluoromethyl)cyclopropyl]phenol?
The InChIKey is FQUZTOVFOBERKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F2O/c11-9(12)10(5-6-10)7-1-3-8(13)4-2-7/h1-4,9,13H,5-6H2.
What are the key properties of 4-[1-(difluoromethyl)cyclopropyl]phenol?
4-[1-(difluoromethyl)cyclopropyl]phenol has a molecular weight of 184.19 g/mol, XLogP of 2.69, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(difluoromethyl)cyclopropyl]phenol is sourced from PubChem (CID 84718814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).