1-(difluoromethyl)cyclopentane-1-carbaldehyde

C7H10F2O — CID 84763056

IUPAC1-(difluoromethyl)cyclopentane-1-carbaldehyde
SMILESO=CC1(C(F)F)CCCC1
InChIInChI=1S/C7H10F2O/c8-6(9)7(5-10)3-1-2-4-7/h5-6H,1-4H2
InChIKeyDZDJKBIDLZUYBE-UHFFFAOYSA-N
MW148.15 g/mol
LogP2.01
Rot. Bonds2

About 1-(difluoromethyl)cyclopentane-1-carbaldehyde

1-(difluoromethyl)cyclopentane-1-carbaldehyde (PubChem CID 84763056) has the molecular formula C7H10F2O and a molecular weight of 148.15 g/mol. Its IUPAC name is 1-(difluoromethyl)cyclopentane-1-carbaldehyde.

Molecular Properties

Compound Name1-(difluoromethyl)cyclopentane-1-carbaldehyde
PubChem CID84763056
Molecular FormulaC7H10F2O
Molecular Weight148.15 g/mol
Exact Mass148.07
IUPAC Name1-(difluoromethyl)cyclopentane-1-carbaldehyde
SMILESO=CC1(C(F)F)CCCC1
InChIInChI=1S/C7H10F2O/c8-6(9)7(5-10)3-1-2-4-7/h5-6H,1-4H2
InChIKeyDZDJKBIDLZUYBE-UHFFFAOYSA-N
XLogP2.01
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.15
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 84768141
4-(difluoromethyl)piperidine-4-carbaldehyde
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1-(3-hydroxybutan-2-yl)cycloheptane-1-carbaldehyde
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1-(3-methylbutan-2-yl)cyclopropane-1-carbaldehyde
CID 130672670
2-(difluoromethyl)oxirane-2-carbaldehyde
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1-(difluoromethyl)-1-methylcyclopentane
CID 134531916
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CID 165452874
1-hydroxycyclooctane-1-carbaldehyde
CID 130025311
1-(difluoromethyl)cyclododecan-1-amine
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Frequently Asked Questions

What is the IUPAC name of 1-(difluoromethyl)cyclopentane-1-carbaldehyde?
The IUPAC name of 1-(difluoromethyl)cyclopentane-1-carbaldehyde (CID 84763056) is 1-(difluoromethyl)cyclopentane-1-carbaldehyde.
What is the SMILES notation for 1-(difluoromethyl)cyclopentane-1-carbaldehyde?
The canonical SMILES for 1-(difluoromethyl)cyclopentane-1-carbaldehyde is O=CC1(C(F)F)CCCC1.
What is the InChIKey of 1-(difluoromethyl)cyclopentane-1-carbaldehyde?
The InChIKey is DZDJKBIDLZUYBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10F2O/c8-6(9)7(5-10)3-1-2-4-7/h5-6H,1-4H2.
What are the key properties of 1-(difluoromethyl)cyclopentane-1-carbaldehyde?
1-(difluoromethyl)cyclopentane-1-carbaldehyde has a molecular weight of 148.15 g/mol, XLogP of 2.01, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(difluoromethyl)cyclopentane-1-carbaldehyde is sourced from PubChem (CID 84763056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).