2-fluoro-3,3,4,5-tetramethyl-2H-furan

C8H13FO — CID 123896136

IUPAC2-fluoro-3,3,4,5-tetramethyl-2H-furan
SMILESCC1=C(C)C(C)(C)C(F)O1
InChIInChI=1S/C8H13FO/c1-5-6(2)10-7(9)8(5,3)4/h7H,1-4H3
InChIKeyHHLQUYBTXBPVQS-UHFFFAOYSA-N
MW144.19 g/mol
LogP2.63
Rot. Bonds

About 2-fluoro-3,3,4,5-tetramethyl-2H-furan

2-fluoro-3,3,4,5-tetramethyl-2H-furan (PubChem CID 123896136) has the molecular formula C8H13FO and a molecular weight of 144.19 g/mol. Its IUPAC name is 2-fluoro-3,3,4,5-tetramethyl-2H-furan.

Molecular Properties

Compound Name2-fluoro-3,3,4,5-tetramethyl-2H-furan
PubChem CID123896136
Molecular FormulaC8H13FO
Molecular Weight144.19 g/mol
Exact Mass144.10
IUPAC Name2-fluoro-3,3,4,5-tetramethyl-2H-furan
SMILESCC1=C(C)C(C)(C)C(F)O1
InChIInChI=1S/C8H13FO/c1-5-6(2)10-7(9)8(5,3)4/h7H,1-4H3
InChIKeyHHLQUYBTXBPVQS-UHFFFAOYSA-N
XLogP2.63
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.19
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 15012571
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CID 144269604
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CID 57531847
CID 57531847
CID 59129232
CID 59129232
CID 68390315
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CID 68391466
CID 68391466
CID 68391594
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CID 89141239
CID 89141239

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-3,3,4,5-tetramethyl-2H-furan?
The IUPAC name of 2-fluoro-3,3,4,5-tetramethyl-2H-furan (CID 123896136) is 2-fluoro-3,3,4,5-tetramethyl-2H-furan.
What is the SMILES notation for 2-fluoro-3,3,4,5-tetramethyl-2H-furan?
The canonical SMILES for 2-fluoro-3,3,4,5-tetramethyl-2H-furan is CC1=C(C)C(C)(C)C(F)O1.
What is the InChIKey of 2-fluoro-3,3,4,5-tetramethyl-2H-furan?
The InChIKey is HHLQUYBTXBPVQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13FO/c1-5-6(2)10-7(9)8(5,3)4/h7H,1-4H3.
What are the key properties of 2-fluoro-3,3,4,5-tetramethyl-2H-furan?
2-fluoro-3,3,4,5-tetramethyl-2H-furan has a molecular weight of 144.19 g/mol, XLogP of 2.63, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-3,3,4,5-tetramethyl-2H-furan is sourced from PubChem (CID 123896136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).