2-(difluoromethyl)-4-(1-hydroxycyclopropyl)phenol

C10H10F2O2 — CID 117289131

IUPAC2-(difluoromethyl)-4-(1-hydroxycyclopropyl)phenol
SMILESOc1ccc(C2(O)CC2)cc1C(F)F
InChIInChI=1S/C10H10F2O2/c11-9(12)7-5-6(1-2-8(7)13)10(14)3-4-10/h1-2,5,9,13-14H,3-4H2
InChIKeyHNNMLFSDSVAWOO-UHFFFAOYSA-N
MW200.18 g/mol
LogP2.31
Rot. Bonds2

About 2-(difluoromethyl)-4-(1-hydroxycyclopropyl)phenol

2-(difluoromethyl)-4-(1-hydroxycyclopropyl)phenol (PubChem CID 117289131) has the molecular formula C10H10F2O2 and a molecular weight of 200.18 g/mol. Its IUPAC name is 2-(difluoromethyl)-4-(1-hydroxycyclopropyl)phenol.

Molecular Properties

Compound Name2-(difluoromethyl)-4-(1-hydroxycyclopropyl)phenol
PubChem CID117289131
Molecular FormulaC10H10F2O2
Molecular Weight200.18 g/mol
Exact Mass200.06
IUPAC Name2-(difluoromethyl)-4-(1-hydroxycyclopropyl)phenol
SMILESOc1ccc(C2(O)CC2)cc1C(F)F
InChIInChI=1S/C10H10F2O2/c11-9(12)7-5-6(1-2-8(7)13)10(14)3-4-10/h1-2,5,9,13-14H,3-4H2
InChIKeyHNNMLFSDSVAWOO-UHFFFAOYSA-N
XLogP2.31
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.18
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(difluoromethyl)-4-(1-hydroxycyclopropyl)phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-4-(1-hydroxycyclopropyl)phenol?
The IUPAC name of 2-(difluoromethyl)-4-(1-hydroxycyclopropyl)phenol (CID 117289131) is 2-(difluoromethyl)-4-(1-hydroxycyclopropyl)phenol.
What is the SMILES notation for 2-(difluoromethyl)-4-(1-hydroxycyclopropyl)phenol?
The canonical SMILES for 2-(difluoromethyl)-4-(1-hydroxycyclopropyl)phenol is Oc1ccc(C2(O)CC2)cc1C(F)F.
What is the InChIKey of 2-(difluoromethyl)-4-(1-hydroxycyclopropyl)phenol?
The InChIKey is HNNMLFSDSVAWOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F2O2/c11-9(12)7-5-6(1-2-8(7)13)10(14)3-4-10/h1-2,5,9,13-14H,3-4H2.
What are the key properties of 2-(difluoromethyl)-4-(1-hydroxycyclopropyl)phenol?
2-(difluoromethyl)-4-(1-hydroxycyclopropyl)phenol has a molecular weight of 200.18 g/mol, XLogP of 2.31, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-4-(1-hydroxycyclopropyl)phenol is sourced from PubChem (CID 117289131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).