(2,2-difluoro-1-methylcyclopropyl)methanol

C5H8F2O — CID 14695233

IUPAC(2,2-difluoro-1-methylcyclopropyl)methanol
SMILESCC1(CO)CC1(F)F
InChIInChI=1S/C5H8F2O/c1-4(3-8)2-5(4,6)7/h8H,2-3H2,1H3
InChIKeyLVSLCFWHJCUZNL-UHFFFAOYSA-N
MW122.11 g/mol
LogP1.02
Rot. Bonds1

About (2,2-difluoro-1-methylcyclopropyl)methanol

(2,2-difluoro-1-methylcyclopropyl)methanol (PubChem CID 14695233) has the molecular formula C5H8F2O and a molecular weight of 122.11 g/mol. Its IUPAC name is (2,2-difluoro-1-methylcyclopropyl)methanol.

Molecular Properties

Compound Name(2,2-difluoro-1-methylcyclopropyl)methanol
PubChem CID14695233
Molecular FormulaC5H8F2O
Molecular Weight122.11 g/mol
Exact Mass122.05
IUPAC Name(2,2-difluoro-1-methylcyclopropyl)methanol
SMILESCC1(CO)CC1(F)F
InChIInChI=1S/C5H8F2O/c1-4(3-8)2-5(4,6)7/h8H,2-3H2,1H3
InChIKeyLVSLCFWHJCUZNL-UHFFFAOYSA-N
XLogP1.02
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
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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Related Compounds

(1-Methylcyclopropyl)methanol
CID 137701
[2,2-Difluoro-1-(hydroxymethyl)cyclopropyl]methanol
CID 15421748
3,3,3-Trifluoro-2,2-dimethylpropan-1-ol
CID 59951355
4,4,4-Trifluoro-3-methylbutan-1-ol
CID 274355
4,4,4-Trifluoro-2-methylbutan-1-ol
CID 2775532
1-(Trifluoromethyl)cyclopropanemethanol
CID 50990661
[1-(Fluoromethyl)cyclopropyl]methanol
CID 55267292
2,2-Difluoro-3-methylbutan-1-ol
CID 57675516
(1-(Difluoromethyl)cyclopropyl)methanol
CID 84762143
4,4,4-Trifluoro-3,3-dimethylbutan-1-ol
CID 118496722
3,3-Difluoro-2,2-dimethylpropan-1-ol
CID 121206990
4,4-Difluoro-2-methylbutan-1-ol
CID 121553246

Frequently Asked Questions

What is the IUPAC name of (2,2-difluoro-1-methylcyclopropyl)methanol?
The IUPAC name of (2,2-difluoro-1-methylcyclopropyl)methanol (CID 14695233) is (2,2-difluoro-1-methylcyclopropyl)methanol.
What is the SMILES notation for (2,2-difluoro-1-methylcyclopropyl)methanol?
The canonical SMILES for (2,2-difluoro-1-methylcyclopropyl)methanol is CC1(CO)CC1(F)F.
What is the InChIKey of (2,2-difluoro-1-methylcyclopropyl)methanol?
The InChIKey is LVSLCFWHJCUZNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8F2O/c1-4(3-8)2-5(4,6)7/h8H,2-3H2,1H3.
What are the key properties of (2,2-difluoro-1-methylcyclopropyl)methanol?
(2,2-difluoro-1-methylcyclopropyl)methanol has a molecular weight of 122.11 g/mol, XLogP of 1.02, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2-difluoro-1-methylcyclopropyl)methanol is sourced from PubChem (CID 14695233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).