fluoro-(oxolan-3-yl)-phenylmethanol

C11H13FO2 — CID 66875231

IUPACfluoro-(oxolan-3-yl)-phenylmethanol
SMILESOC(F)(c1ccccc1)C1CCOC1
InChIInChI=1S/C11H13FO2/c12-11(13,10-6-7-14-8-10)9-4-2-1-3-5-9/h1-5,10,13H,6-8H2
InChIKeyQNCJBJUTJSTWIL-UHFFFAOYSA-N
MW196.22 g/mol
LogP1.84
Rot. Bonds2

About fluoro-(oxolan-3-yl)-phenylmethanol

fluoro-(oxolan-3-yl)-phenylmethanol (PubChem CID 66875231) has the molecular formula C11H13FO2 and a molecular weight of 196.22 g/mol. Its IUPAC name is fluoro-(oxolan-3-yl)-phenylmethanol.

Molecular Properties

Compound Namefluoro-(oxolan-3-yl)-phenylmethanol
PubChem CID66875231
Molecular FormulaC11H13FO2
Molecular Weight196.22 g/mol
Exact Mass196.09
IUPAC Namefluoro-(oxolan-3-yl)-phenylmethanol
SMILESOC(F)(c1ccccc1)C1CCOC1
InChIInChI=1S/C11H13FO2/c12-11(13,10-6-7-14-8-10)9-4-2-1-3-5-9/h1-5,10,13H,6-8H2
InChIKeyQNCJBJUTJSTWIL-UHFFFAOYSA-N
XLogP1.84
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.22
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Fluoro-1-phenylethan-1-ol
CID 9946
2,4-Butanediol, 4-phenyl-1,1,1-trifluoro-2-(trifluoromethyl)-
CID 36952
Cyclopentyl(phenyl)methanol
CID 316741
(1S)-2-methyl-1-phenylpropan-1-ol
CID 5325937
2-Methyl-1-phenyl-1-propanol
CID 95626
4-Phenyloxan-4-ol
CID 2741305
(R)-(+)-1-Phenyl-1,3-propanediol
CID 2735120
(1S)-1-phenylpropane-1,3-diol
CID 6950537
3-(Benzyloxy)-2-fluoropropan-1-ol
CID 14003285
3-Methylene-1-phenyl-1,4-butanediol
CID 359266
alpha-Cyclopropyl-4-fluorobenzenemethanol
CID 102498
(1R)-2-fluoro-1-phenylethan-1-ol
CID 11344059

Frequently Asked Questions

What is the IUPAC name of fluoro-(oxolan-3-yl)-phenylmethanol?
The IUPAC name of fluoro-(oxolan-3-yl)-phenylmethanol (CID 66875231) is fluoro-(oxolan-3-yl)-phenylmethanol.
What is the SMILES notation for fluoro-(oxolan-3-yl)-phenylmethanol?
The canonical SMILES for fluoro-(oxolan-3-yl)-phenylmethanol is OC(F)(c1ccccc1)C1CCOC1.
What is the InChIKey of fluoro-(oxolan-3-yl)-phenylmethanol?
The InChIKey is QNCJBJUTJSTWIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FO2/c12-11(13,10-6-7-14-8-10)9-4-2-1-3-5-9/h1-5,10,13H,6-8H2.
What are the key properties of fluoro-(oxolan-3-yl)-phenylmethanol?
fluoro-(oxolan-3-yl)-phenylmethanol has a molecular weight of 196.22 g/mol, XLogP of 1.84, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for fluoro-(oxolan-3-yl)-phenylmethanol is sourced from PubChem (CID 66875231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).