2,3-difluoro-5-(2-methylhexan-2-yl)furan

C11H16F2O — CID 146378308

IUPAC2,3-difluoro-5-(2-methylhexan-2-yl)furan
SMILESCCCCC(C)(C)c1cc(F)c(F)o1
InChIInChI=1S/C11H16F2O/c1-4-5-6-11(2,3)9-7-8(12)10(13)14-9/h7H,4-6H2,1-3H3
InChIKeyHOPMBGNGIHXPFD-UHFFFAOYSA-N
MW202.24 g/mol
LogP4.03
Rot. Bonds4

About 2,3-difluoro-5-(2-methylhexan-2-yl)furan

2,3-difluoro-5-(2-methylhexan-2-yl)furan (PubChem CID 146378308) has the molecular formula C11H16F2O and a molecular weight of 202.24 g/mol. Its IUPAC name is 2,3-difluoro-5-(2-methylhexan-2-yl)furan.

Molecular Properties

Compound Name2,3-difluoro-5-(2-methylhexan-2-yl)furan
PubChem CID146378308
Molecular FormulaC11H16F2O
Molecular Weight202.24 g/mol
Exact Mass202.12
IUPAC Name2,3-difluoro-5-(2-methylhexan-2-yl)furan
SMILESCCCCC(C)(C)c1cc(F)c(F)o1
InChIInChI=1S/C11H16F2O/c1-4-5-6-11(2,3)9-7-8(12)10(13)14-9/h7H,4-6H2,1-3H3
InChIKeyHOPMBGNGIHXPFD-UHFFFAOYSA-N
XLogP4.03
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.24
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3-difluoro-5-(2-methylhexan-2-yl)furan?
The IUPAC name of 2,3-difluoro-5-(2-methylhexan-2-yl)furan (CID 146378308) is 2,3-difluoro-5-(2-methylhexan-2-yl)furan.
What is the SMILES notation for 2,3-difluoro-5-(2-methylhexan-2-yl)furan?
The canonical SMILES for 2,3-difluoro-5-(2-methylhexan-2-yl)furan is CCCCC(C)(C)c1cc(F)c(F)o1.
What is the InChIKey of 2,3-difluoro-5-(2-methylhexan-2-yl)furan?
The InChIKey is HOPMBGNGIHXPFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16F2O/c1-4-5-6-11(2,3)9-7-8(12)10(13)14-9/h7H,4-6H2,1-3H3.
What are the key properties of 2,3-difluoro-5-(2-methylhexan-2-yl)furan?
2,3-difluoro-5-(2-methylhexan-2-yl)furan has a molecular weight of 202.24 g/mol, XLogP of 4.03, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-difluoro-5-(2-methylhexan-2-yl)furan is sourced from PubChem (CID 146378308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).