1-(1,1-difluoropentoxy)-1,1-difluoropentane

C10H18F4O — CID 121434513

IUPAC1-(1,1-difluoropentoxy)-1,1-difluoropentane
SMILESCCCCC(F)(F)OC(F)(F)CCCC
InChIInChI=1S/C10H18F4O/c1-3-5-7-9(11,12)15-10(13,14)8-6-4-2/h3-8H2,1-2H3
InChIKeyHONJLQAVDZLKRW-UHFFFAOYSA-N
MW230.24 g/mol
LogP4.57
Rot. Bonds8

About 1-(1,1-difluoropentoxy)-1,1-difluoropentane

1-(1,1-difluoropentoxy)-1,1-difluoropentane (PubChem CID 121434513) has the molecular formula C10H18F4O and a molecular weight of 230.24 g/mol. Its IUPAC name is 1-(1,1-difluoropentoxy)-1,1-difluoropentane.

Molecular Properties

Compound Name1-(1,1-difluoropentoxy)-1,1-difluoropentane
PubChem CID121434513
Molecular FormulaC10H18F4O
Molecular Weight230.24 g/mol
Exact Mass230.13
IUPAC Name1-(1,1-difluoropentoxy)-1,1-difluoropentane
SMILESCCCCC(F)(F)OC(F)(F)CCCC
InChIInChI=1S/C10H18F4O/c1-3-5-7-9(11,12)15-10(13,14)8-6-4-2/h3-8H2,1-2H3
InChIKeyHONJLQAVDZLKRW-UHFFFAOYSA-N
XLogP4.57
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.24
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-ethoxy-1,1-difluoropentane
CID 21052612
3-(1,1-difluoropentoxy)-2,2,3,3-tetrafluoropropanenitrile
CID 161088452
5,5-difluorononane
CID 21410163
iron(3+);1,1,1-trifluoropentane
CID 161198772
5-butyl-5-(5-butylnonan-5-yloxy)nonane
CID 57230356
ethane;2-fluoro-2-methylhexane
CID 142890341
6-butyl-6-fluoroundecane
CID 11424735
ethane;1,1,1,2,2-pentafluorohexane
CID 167481670
5-fluoro-5-methoxyhexadecane
CID 176907960
4,4-bis(trifluoromethyl)octane
CID 162621098
5,8-dibutyl-5,8-diethyldodecane
CID 140960006
3-methyl-3-(trifluoromethyl)heptane
CID 142541633

Frequently Asked Questions

What is the IUPAC name of 1-(1,1-difluoropentoxy)-1,1-difluoropentane?
The IUPAC name of 1-(1,1-difluoropentoxy)-1,1-difluoropentane (CID 121434513) is 1-(1,1-difluoropentoxy)-1,1-difluoropentane.
What is the SMILES notation for 1-(1,1-difluoropentoxy)-1,1-difluoropentane?
The canonical SMILES for 1-(1,1-difluoropentoxy)-1,1-difluoropentane is CCCCC(F)(F)OC(F)(F)CCCC.
What is the InChIKey of 1-(1,1-difluoropentoxy)-1,1-difluoropentane?
The InChIKey is HONJLQAVDZLKRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F4O/c1-3-5-7-9(11,12)15-10(13,14)8-6-4-2/h3-8H2,1-2H3.
What are the key properties of 1-(1,1-difluoropentoxy)-1,1-difluoropentane?
1-(1,1-difluoropentoxy)-1,1-difluoropentane has a molecular weight of 230.24 g/mol, XLogP of 4.57, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,1-difluoropentoxy)-1,1-difluoropentane is sourced from PubChem (CID 121434513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).