1,1-difluoro-2-methoxycyclohexane

C7H12F2O — CID 14092089

IUPAC1,1-difluoro-2-methoxycyclohexane
SMILESCOC1CCCCC1(F)F
InChIInChI=1S/C7H12F2O/c1-10-6-4-2-3-5-7(6,8)9/h6H,2-5H2,1H3
InChIKeyUJZHVASRETWYEC-UHFFFAOYSA-N
MW150.17 g/mol
LogP2.21
Rot. Bonds1

About 1,1-difluoro-2-methoxycyclohexane

1,1-difluoro-2-methoxycyclohexane (PubChem CID 14092089) has the molecular formula C7H12F2O and a molecular weight of 150.17 g/mol. Its IUPAC name is 1,1-difluoro-2-methoxycyclohexane.

Molecular Properties

Compound Name1,1-difluoro-2-methoxycyclohexane
PubChem CID14092089
Molecular FormulaC7H12F2O
Molecular Weight150.17 g/mol
Exact Mass150.09
IUPAC Name1,1-difluoro-2-methoxycyclohexane
SMILESCOC1CCCCC1(F)F
InChIInChI=1S/C7H12F2O/c1-10-6-4-2-3-5-7(6,8)9/h6H,2-5H2,1H3
InChIKeyUJZHVASRETWYEC-UHFFFAOYSA-N
XLogP2.21
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.17
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Cyclohexyl methyl ether
CID 13607
Cyclohexane, (1,1,2,2-tetrafluoroethoxy)-
CID 120674
(1R,2R)-1-Fluoro-2-methoxycyclohexane
CID 12700789
2,2,2-Trifluoroethoxycyclohexane
CID 15806350
2,2,3,3-Tetrafluoropropyloxycyclohexane
CID 24854146
1-(Trifluoromethoxy)cyclohexane
CID 44195355
2,2,3,3,4,4,5,5-Octafluoropentoxycyclohexane
CID 129766523
cis-(1R,2S)-1-fluoro-2-methoxycyclohexane
CID 101665102
trans-(1S,2S)-1-fluoro-2-methoxycyclohexane
CID 101993893
trans-(1S,2S)-1-ethoxy-2-(trifluoromethylselanyl)cyclohexane
CID 138974150
1,1,1,3,3,3-Hexafluoropropan-2-yloxycyclohexane
CID 21638553
1-Fluoro-2-methoxycyclohexane
CID 12700788

Frequently Asked Questions

What is the IUPAC name of 1,1-difluoro-2-methoxycyclohexane?
The IUPAC name of 1,1-difluoro-2-methoxycyclohexane (CID 14092089) is 1,1-difluoro-2-methoxycyclohexane.
What is the SMILES notation for 1,1-difluoro-2-methoxycyclohexane?
The canonical SMILES for 1,1-difluoro-2-methoxycyclohexane is COC1CCCCC1(F)F.
What is the InChIKey of 1,1-difluoro-2-methoxycyclohexane?
The InChIKey is UJZHVASRETWYEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12F2O/c1-10-6-4-2-3-5-7(6,8)9/h6H,2-5H2,1H3.
What are the key properties of 1,1-difluoro-2-methoxycyclohexane?
1,1-difluoro-2-methoxycyclohexane has a molecular weight of 150.17 g/mol, XLogP of 2.21, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoro-2-methoxycyclohexane is sourced from PubChem (CID 14092089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).