1-(3-fluoro-2-methylphenyl)cyclopropan-1-ol

C10H11FO — CID 117276386

IUPAC1-(3-fluoro-2-methylphenyl)cyclopropan-1-ol
SMILESCc1c(F)cccc1C1(O)CC1
InChIInChI=1S/C10H11FO/c1-7-8(10(12)5-6-10)3-2-4-9(7)11/h2-4,12H,5-6H2,1H3
InChIKeyGHKWWJVUPUCHRO-UHFFFAOYSA-N
MW166.19 g/mol
LogP2.12
Rot. Bonds1

About 1-(3-fluoro-2-methylphenyl)cyclopropan-1-ol

1-(3-fluoro-2-methylphenyl)cyclopropan-1-ol (PubChem CID 117276386) has the molecular formula C10H11FO and a molecular weight of 166.19 g/mol. Its IUPAC name is 1-(3-fluoro-2-methylphenyl)cyclopropan-1-ol.

Molecular Properties

Compound Name1-(3-fluoro-2-methylphenyl)cyclopropan-1-ol
PubChem CID117276386
Molecular FormulaC10H11FO
Molecular Weight166.19 g/mol
Exact Mass166.08
IUPAC Name1-(3-fluoro-2-methylphenyl)cyclopropan-1-ol
SMILESCc1c(F)cccc1C1(O)CC1
InChIInChI=1S/C10H11FO/c1-7-8(10(12)5-6-10)3-2-4-9(7)11/h2-4,12H,5-6H2,1H3
InChIKeyGHKWWJVUPUCHRO-UHFFFAOYSA-N
XLogP2.12
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.19
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-2-methylphenyl)cyclopropan-1-ol?
The IUPAC name of 1-(3-fluoro-2-methylphenyl)cyclopropan-1-ol (CID 117276386) is 1-(3-fluoro-2-methylphenyl)cyclopropan-1-ol.
What is the SMILES notation for 1-(3-fluoro-2-methylphenyl)cyclopropan-1-ol?
The canonical SMILES for 1-(3-fluoro-2-methylphenyl)cyclopropan-1-ol is Cc1c(F)cccc1C1(O)CC1.
What is the InChIKey of 1-(3-fluoro-2-methylphenyl)cyclopropan-1-ol?
The InChIKey is GHKWWJVUPUCHRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FO/c1-7-8(10(12)5-6-10)3-2-4-9(7)11/h2-4,12H,5-6H2,1H3.
What are the key properties of 1-(3-fluoro-2-methylphenyl)cyclopropan-1-ol?
1-(3-fluoro-2-methylphenyl)cyclopropan-1-ol has a molecular weight of 166.19 g/mol, XLogP of 2.12, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-2-methylphenyl)cyclopropan-1-ol is sourced from PubChem (CID 117276386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).