2,2-difluoro-1-[5-(2-methylcyclopropyl)furan-2-yl]ethanol

C10H12F2O2 — CID 80605926

IUPAC2,2-difluoro-1-[5-(2-methylcyclopropyl)furan-2-yl]ethanol
SMILESCC1CC1c1ccc(C(O)C(F)F)o1
InChIInChI=1S/C10H12F2O2/c1-5-4-6(5)7-2-3-8(14-7)9(13)10(11)12/h2-3,5-6,9-10,13H,4H2,1H3
InChIKeyYNZYZBODBAIZBM-UHFFFAOYSA-N
MW202.20 g/mol
LogP2.70
Rot. Bonds3

About 2,2-difluoro-1-[5-(2-methylcyclopropyl)furan-2-yl]ethanol

2,2-difluoro-1-[5-(2-methylcyclopropyl)furan-2-yl]ethanol (PubChem CID 80605926) has the molecular formula C10H12F2O2 and a molecular weight of 202.20 g/mol. Its IUPAC name is 2,2-difluoro-1-[5-(2-methylcyclopropyl)furan-2-yl]ethanol.

Molecular Properties

Compound Name2,2-difluoro-1-[5-(2-methylcyclopropyl)furan-2-yl]ethanol
PubChem CID80605926
Molecular FormulaC10H12F2O2
Molecular Weight202.20 g/mol
Exact Mass202.08
IUPAC Name2,2-difluoro-1-[5-(2-methylcyclopropyl)furan-2-yl]ethanol
SMILESCC1CC1c1ccc(C(O)C(F)F)o1
InChIInChI=1S/C10H12F2O2/c1-5-4-6(5)7-2-3-8(14-7)9(13)10(11)12/h2-3,5-6,9-10,13H,4H2,1H3
InChIKeyYNZYZBODBAIZBM-UHFFFAOYSA-N
XLogP2.70
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.20
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Bipinnatin J
CID 5470115
2-(1-Hydroxypropyl)furan
CID 33640
Kallolide A
CID 394352
2,2,2-Trifluoro-1-(furan-2-yl)ethan-1-ol
CID 2760709
(Furan-2-yl)(phenyl)methanol
CID 3746348
2-Furanmethanol, alpha-pentyl-
CID 85710
3-[Furan-2-yl(hydroxy)methyl]but-3-en-2-one
CID 12556270
1,1,1,3,3,3-Hexafluoro-2-(5-methylfuran-2-yl)propan-2-ol
CID 573264
(5-Benzylfuran-2-yl)methanol
CID 30149
(5-Phenylfuran-2-yl)methanol
CID 960786
1-(5-Methylfuran-2-yl)but-3-en-1-ol
CID 11062557
5-(1-Methylethyl)-2-furancarboxylic acid
CID 12207633

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-1-[5-(2-methylcyclopropyl)furan-2-yl]ethanol?
The IUPAC name of 2,2-difluoro-1-[5-(2-methylcyclopropyl)furan-2-yl]ethanol (CID 80605926) is 2,2-difluoro-1-[5-(2-methylcyclopropyl)furan-2-yl]ethanol.
What is the SMILES notation for 2,2-difluoro-1-[5-(2-methylcyclopropyl)furan-2-yl]ethanol?
The canonical SMILES for 2,2-difluoro-1-[5-(2-methylcyclopropyl)furan-2-yl]ethanol is CC1CC1c1ccc(C(O)C(F)F)o1.
What is the InChIKey of 2,2-difluoro-1-[5-(2-methylcyclopropyl)furan-2-yl]ethanol?
The InChIKey is YNZYZBODBAIZBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F2O2/c1-5-4-6(5)7-2-3-8(14-7)9(13)10(11)12/h2-3,5-6,9-10,13H,4H2,1H3.
What are the key properties of 2,2-difluoro-1-[5-(2-methylcyclopropyl)furan-2-yl]ethanol?
2,2-difluoro-1-[5-(2-methylcyclopropyl)furan-2-yl]ethanol has a molecular weight of 202.20 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-1-[5-(2-methylcyclopropyl)furan-2-yl]ethanol is sourced from PubChem (CID 80605926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).