[1-(difluoromethyl)cyclopropyl]methanol

C5H8F2O — CID 84762143

IUPAC[1-(difluoromethyl)cyclopropyl]methanol
SMILESOCC1(C(F)F)CC1
InChIInChI=1S/C5H8F2O/c6-4(7)5(3-8)1-2-5/h4,8H,1-3H2
InChIKeyPPYIICYIHBXOEB-UHFFFAOYSA-N
MW122.11 g/mol
LogP1.02
Rot. Bonds2

About [1-(difluoromethyl)cyclopropyl]methanol

[1-(difluoromethyl)cyclopropyl]methanol (PubChem CID 84762143) has the molecular formula C5H8F2O and a molecular weight of 122.11 g/mol. Its IUPAC name is [1-(difluoromethyl)cyclopropyl]methanol.

Molecular Properties

Compound Name[1-(difluoromethyl)cyclopropyl]methanol
PubChem CID84762143
Molecular FormulaC5H8F2O
Molecular Weight122.11 g/mol
Exact Mass122.05
IUPAC Name[1-(difluoromethyl)cyclopropyl]methanol
SMILESOCC1(C(F)F)CC1
InChIInChI=1S/C5H8F2O/c6-4(7)5(3-8)1-2-5/h4,8H,1-3H2
InChIKeyPPYIICYIHBXOEB-UHFFFAOYSA-N
XLogP1.02
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.11
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [1-(difluoromethyl)cyclopropyl]methanol?
The IUPAC name of [1-(difluoromethyl)cyclopropyl]methanol (CID 84762143) is [1-(difluoromethyl)cyclopropyl]methanol.
What is the SMILES notation for [1-(difluoromethyl)cyclopropyl]methanol?
The canonical SMILES for [1-(difluoromethyl)cyclopropyl]methanol is OCC1(C(F)F)CC1.
What is the InChIKey of [1-(difluoromethyl)cyclopropyl]methanol?
The InChIKey is PPYIICYIHBXOEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8F2O/c6-4(7)5(3-8)1-2-5/h4,8H,1-3H2.
What are the key properties of [1-(difluoromethyl)cyclopropyl]methanol?
[1-(difluoromethyl)cyclopropyl]methanol has a molecular weight of 122.11 g/mol, XLogP of 1.02, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(difluoromethyl)cyclopropyl]methanol is sourced from PubChem (CID 84762143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).