CID 59369470

C7H11FO — CID 59369470

IUPAC—
SMILES[CH]CC1(F)CCOCC1
InChIInChI=1S/C7H11FO/c1-2-7(8)3-5-9-6-4-7/h1H,2-6H2
InChIKeyJHKIDGWXCVFXCQ-UHFFFAOYSA-N
MW130.16 g/mol
LogP1.61
Rot. Bonds1

About CID 59369470

CID 59369470 (PubChem CID 59369470) has the molecular formula C7H11FO and a molecular weight of 130.16 g/mol.

Molecular Properties

Compound NameCID 59369470
PubChem CID59369470
Molecular FormulaC7H11FO
Molecular Weight130.16 g/mol
Exact Mass130.08
IUPAC Name—
SMILES[CH]CC1(F)CCOCC1
InChIInChI=1S/C7H11FO/c1-2-7(8)3-5-9-6-4-7/h1H,2-6H2
InChIKeyJHKIDGWXCVFXCQ-UHFFFAOYSA-N
XLogP1.61
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.16
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Tetrahydro-4-methyl-2H-pyran
CID 78446
2-Fluorooxane
CID 18472016
4-(Trifluoromethyl)tetrahydro-2H-pyran
CID 54105449
2H-Pyran, 4-(difluoromethyl)tetrahydro-
CID 97890136
2-Fluoro-4-methyltetrahydropyran
CID 129723629
(5S)-5-fluoro-3,4,5,6-tetrahydro-2H-pyran-6-ylium
CID 134857993
4-Ethyloxane
CID 21482444
2H-Pyran, 3-fluorotetrahydro-
CID 10942361
3-(Fluoromethyl)oxane
CID 15311411
2,2,4,5,5-Pentafluoro-4-(fluoromethyl)oxane
CID 53839736
4-fluorotetrahydro-2H-pyran
CID 57418184
3-Fluoro-4-methyloxane
CID 59734978

Frequently Asked Questions

What is the IUPAC name of CID 59369470?
The IUPAC name of CID 59369470 (CID 59369470) is not available.
What is the SMILES notation for CID 59369470?
The canonical SMILES for CID 59369470 is [CH]CC1(F)CCOCC1.
What is the InChIKey of CID 59369470?
The InChIKey is JHKIDGWXCVFXCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11FO/c1-2-7(8)3-5-9-6-4-7/h1H,2-6H2.
What are the key properties of CID 59369470?
CID 59369470 has a molecular weight of 130.16 g/mol, XLogP of 1.61, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59369470 is sourced from PubChem (CID 59369470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).