[1-(1,1-difluoroprop-2-enyl)cyclopropyl]methanol

C7H10F2O — CID 170393916

IUPAC[1-(1,1-difluoroprop-2-enyl)cyclopropyl]methanol
SMILESC=CC(F)(F)C1(CO)CC1
InChIInChI=1S/C7H10F2O/c1-2-7(8,9)6(5-10)3-4-6/h2,10H,1,3-5H2
InChIKeyNWSSXJZKHPPJOP-UHFFFAOYSA-N
MW148.15 g/mol
LogP1.58
Rot. Bonds3

About [1-(1,1-difluoroprop-2-enyl)cyclopropyl]methanol

[1-(1,1-difluoroprop-2-enyl)cyclopropyl]methanol (PubChem CID 170393916) has the molecular formula C7H10F2O and a molecular weight of 148.15 g/mol. Its IUPAC name is [1-(1,1-difluoroprop-2-enyl)cyclopropyl]methanol.

Molecular Properties

Compound Name[1-(1,1-difluoroprop-2-enyl)cyclopropyl]methanol
PubChem CID170393916
Molecular FormulaC7H10F2O
Molecular Weight148.15 g/mol
Exact Mass148.07
IUPAC Name[1-(1,1-difluoroprop-2-enyl)cyclopropyl]methanol
SMILESC=CC(F)(F)C1(CO)CC1
InChIInChI=1S/C7H10F2O/c1-2-7(8,9)6(5-10)3-4-6/h2,10H,1,3-5H2
InChIKeyNWSSXJZKHPPJOP-UHFFFAOYSA-N
XLogP1.58
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.15
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

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CID 134398721
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CID 163203431
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CID 163203441
CID 163203441
CID 171076569
CID 171076569
CID 534677
CID 534677
CID 121208203
CID 121208203
CID 129359651
CID 129359651
CID 129359652
CID 129359652
CID 134163263
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CID 171035724
CID 171035724

Frequently Asked Questions

What is the IUPAC name of [1-(1,1-difluoroprop-2-enyl)cyclopropyl]methanol?
The IUPAC name of [1-(1,1-difluoroprop-2-enyl)cyclopropyl]methanol (CID 170393916) is [1-(1,1-difluoroprop-2-enyl)cyclopropyl]methanol.
What is the SMILES notation for [1-(1,1-difluoroprop-2-enyl)cyclopropyl]methanol?
The canonical SMILES for [1-(1,1-difluoroprop-2-enyl)cyclopropyl]methanol is C=CC(F)(F)C1(CO)CC1.
What is the InChIKey of [1-(1,1-difluoroprop-2-enyl)cyclopropyl]methanol?
The InChIKey is NWSSXJZKHPPJOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10F2O/c1-2-7(8,9)6(5-10)3-4-6/h2,10H,1,3-5H2.
What are the key properties of [1-(1,1-difluoroprop-2-enyl)cyclopropyl]methanol?
[1-(1,1-difluoroprop-2-enyl)cyclopropyl]methanol has a molecular weight of 148.15 g/mol, XLogP of 1.58, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,1-difluoroprop-2-enyl)cyclopropyl]methanol is sourced from PubChem (CID 170393916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).