[(Z)-3,3,3-trifluoro-1-methoxyprop-1-en-2-yl]cyclopentane

C9H13F3O — CID 18986347

IUPAC[(Z)-3,3,3-trifluoro-1-methoxyprop-1-en-2-yl]cyclopentane
SMILESCO/C=C(/C1CCCC1)C(F)(F)F
InChIInChI=1S/C9H13F3O/c1-13-6-8(9(10,11)12)7-4-2-3-5-7/h6-7H,2-5H2,1H3/b8-6-
InChIKeyVSRLICPYSINOLX-VURMDHGXSA-N
MW194.20 g/mol
LogP3.27
Rot. Bonds2

About [(Z)-3,3,3-trifluoro-1-methoxyprop-1-en-2-yl]cyclopentane

[(Z)-3,3,3-trifluoro-1-methoxyprop-1-en-2-yl]cyclopentane (PubChem CID 18986347) has the molecular formula C9H13F3O and a molecular weight of 194.20 g/mol. Its IUPAC name is [(Z)-3,3,3-trifluoro-1-methoxyprop-1-en-2-yl]cyclopentane.

Molecular Properties

Compound Name[(Z)-3,3,3-trifluoro-1-methoxyprop-1-en-2-yl]cyclopentane
PubChem CID18986347
Molecular FormulaC9H13F3O
Molecular Weight194.20 g/mol
Exact Mass194.09
IUPAC Name[(Z)-3,3,3-trifluoro-1-methoxyprop-1-en-2-yl]cyclopentane
SMILESCO/C=C(/C1CCCC1)C(F)(F)F
InChIInChI=1S/C9H13F3O/c1-13-6-8(9(10,11)12)7-4-2-3-5-7/h6-7H,2-5H2,1H3/b8-6-
InChIKeyVSRLICPYSINOLX-VURMDHGXSA-N
XLogP3.27
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.20
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

(3,3,3-Trifluoro-1-methoxyprop-1-en-2-yl)cyclopentane
CID 54408855
1-(Methoxymethylidene)-4-(trifluoromethyl)cyclohexane
CID 68212335
But-1-en-2-ylcyclopentane;ethane;trifluoro(methoxy)methane
CID 145504364
1,1-Difluoro-3-(2-methoxyethenyl)cyclopentane
CID 157795644
[(Z)-1,3,3,3-tetrafluoro-1-methoxyprop-1-en-2-yl]cyclopentane
CID 21731863
[(E)-1,3,3,3-tetrafluoro-1-methoxyprop-1-en-2-yl]cyclopentane
CID 21731864
1-Methoxy-2-(trifluoromethyl)hept-1-ene
CID 71398789
(E)-1-methoxy-2-(trifluoromethyl)hept-1-ene
CID 92033166
(Z)-1-methoxy-2-(trifluoromethyl)hept-1-ene
CID 92033233
1-Methyl-4-(2,2,2-trifluoroethoxymethylidene)cyclohexane
CID 102010409
[(E)-1-methoxyprop-1-en-2-yl]cyclopentane
CID 178513077

Frequently Asked Questions

What is the IUPAC name of [(Z)-3,3,3-trifluoro-1-methoxyprop-1-en-2-yl]cyclopentane?
The IUPAC name of [(Z)-3,3,3-trifluoro-1-methoxyprop-1-en-2-yl]cyclopentane (CID 18986347) is [(Z)-3,3,3-trifluoro-1-methoxyprop-1-en-2-yl]cyclopentane.
What is the SMILES notation for [(Z)-3,3,3-trifluoro-1-methoxyprop-1-en-2-yl]cyclopentane?
The canonical SMILES for [(Z)-3,3,3-trifluoro-1-methoxyprop-1-en-2-yl]cyclopentane is CO/C=C(/C1CCCC1)C(F)(F)F.
What is the InChIKey of [(Z)-3,3,3-trifluoro-1-methoxyprop-1-en-2-yl]cyclopentane?
The InChIKey is VSRLICPYSINOLX-VURMDHGXSA-N. The full InChI is InChI=1S/C9H13F3O/c1-13-6-8(9(10,11)12)7-4-2-3-5-7/h6-7H,2-5H2,1H3/b8-6-.
What are the key properties of [(Z)-3,3,3-trifluoro-1-methoxyprop-1-en-2-yl]cyclopentane?
[(Z)-3,3,3-trifluoro-1-methoxyprop-1-en-2-yl]cyclopentane has a molecular weight of 194.20 g/mol, XLogP of 3.27, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-3,3,3-trifluoro-1-methoxyprop-1-en-2-yl]cyclopentane is sourced from PubChem (CID 18986347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).