1-(difluoromethyl)-1-(2-methylprop-2-enyl)cyclopropane

C8H12F2 — CID 145229739

IUPAC1-(difluoromethyl)-1-(2-methylprop-2-enyl)cyclopropane
SMILESC=C(C)CC1(C(F)F)CC1
InChIInChI=1S/C8H12F2/c1-6(2)5-8(3-4-8)7(9)10/h7H,1,3-5H2,2H3
InChIKeyVXQFRVJISIHAOK-UHFFFAOYSA-N
MW146.18 g/mol
LogP3.00
Rot. Bonds3

About 1-(difluoromethyl)-1-(2-methylprop-2-enyl)cyclopropane

1-(difluoromethyl)-1-(2-methylprop-2-enyl)cyclopropane (PubChem CID 145229739) has the molecular formula C8H12F2 and a molecular weight of 146.18 g/mol. Its IUPAC name is 1-(difluoromethyl)-1-(2-methylprop-2-enyl)cyclopropane.

Molecular Properties

Compound Name1-(difluoromethyl)-1-(2-methylprop-2-enyl)cyclopropane
PubChem CID145229739
Molecular FormulaC8H12F2
Molecular Weight146.18 g/mol
Exact Mass146.09
IUPAC Name1-(difluoromethyl)-1-(2-methylprop-2-enyl)cyclopropane
SMILESC=C(C)CC1(C(F)F)CC1
InChIInChI=1S/C8H12F2/c1-6(2)5-8(3-4-8)7(9)10/h7H,1,3-5H2,2H3
InChIKeyVXQFRVJISIHAOK-UHFFFAOYSA-N
XLogP3.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.18
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

CID 11105399
CID 11105399
CID 13379955
CID 13379955
CID 58514181
CID 58514181
CID 70564307
CID 70564307
CID 117620491
CID 117620491
CID 134570912
CID 134570912
CID 134570945
CID 134570945
CID 137394531
CID 137394531
CID 137451352
CID 137451352
CID 138468401
CID 138468401
CID 138517586
CID 138517586
CID 139296368
CID 139296368

Frequently Asked Questions

What is the IUPAC name of 1-(difluoromethyl)-1-(2-methylprop-2-enyl)cyclopropane?
The IUPAC name of 1-(difluoromethyl)-1-(2-methylprop-2-enyl)cyclopropane (CID 145229739) is 1-(difluoromethyl)-1-(2-methylprop-2-enyl)cyclopropane.
What is the SMILES notation for 1-(difluoromethyl)-1-(2-methylprop-2-enyl)cyclopropane?
The canonical SMILES for 1-(difluoromethyl)-1-(2-methylprop-2-enyl)cyclopropane is C=C(C)CC1(C(F)F)CC1.
What is the InChIKey of 1-(difluoromethyl)-1-(2-methylprop-2-enyl)cyclopropane?
The InChIKey is VXQFRVJISIHAOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12F2/c1-6(2)5-8(3-4-8)7(9)10/h7H,1,3-5H2,2H3.
What are the key properties of 1-(difluoromethyl)-1-(2-methylprop-2-enyl)cyclopropane?
1-(difluoromethyl)-1-(2-methylprop-2-enyl)cyclopropane has a molecular weight of 146.18 g/mol, XLogP of 3.00, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(difluoromethyl)-1-(2-methylprop-2-enyl)cyclopropane is sourced from PubChem (CID 145229739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).