2-cyclopropyl-1,1-difluoropropan-2-ol

C6H10F2O — CID 80610889

IUPAC2-cyclopropyl-1,1-difluoropropan-2-ol
SMILESCC(O)(C(F)F)C1CC1
InChIInChI=1S/C6H10F2O/c1-6(9,5(7)8)4-2-3-4/h4-5,9H,2-3H2,1H3
InChIKeyMDZRFPUJZBNXKV-UHFFFAOYSA-N
MW136.14 g/mol
LogP1.41
Rot. Bonds2

About 2-cyclopropyl-1,1-difluoropropan-2-ol

2-cyclopropyl-1,1-difluoropropan-2-ol (PubChem CID 80610889) has the molecular formula C6H10F2O and a molecular weight of 136.14 g/mol. Its IUPAC name is 2-cyclopropyl-1,1-difluoropropan-2-ol.

Molecular Properties

Compound Name2-cyclopropyl-1,1-difluoropropan-2-ol
PubChem CID80610889
Molecular FormulaC6H10F2O
Molecular Weight136.14 g/mol
Exact Mass136.07
IUPAC Name2-cyclopropyl-1,1-difluoropropan-2-ol
SMILESCC(O)(C(F)F)C1CC1
InChIInChI=1S/C6H10F2O/c1-6(9,5(7)8)4-2-3-4/h4-5,9H,2-3H2,1H3
InChIKeyMDZRFPUJZBNXKV-UHFFFAOYSA-N
XLogP1.41
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.14
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1,1-difluoropropan-2-ol?
The IUPAC name of 2-cyclopropyl-1,1-difluoropropan-2-ol (CID 80610889) is 2-cyclopropyl-1,1-difluoropropan-2-ol.
What is the SMILES notation for 2-cyclopropyl-1,1-difluoropropan-2-ol?
The canonical SMILES for 2-cyclopropyl-1,1-difluoropropan-2-ol is CC(O)(C(F)F)C1CC1.
What is the InChIKey of 2-cyclopropyl-1,1-difluoropropan-2-ol?
The InChIKey is MDZRFPUJZBNXKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F2O/c1-6(9,5(7)8)4-2-3-4/h4-5,9H,2-3H2,1H3.
What are the key properties of 2-cyclopropyl-1,1-difluoropropan-2-ol?
2-cyclopropyl-1,1-difluoropropan-2-ol has a molecular weight of 136.14 g/mol, XLogP of 1.41, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1,1-difluoropropan-2-ol is sourced from PubChem (CID 80610889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).