acetic acid;2-fluoronaphthalene

C12H11FO2 — CID 174506324

IUPACacetic acid;2-fluoronaphthalene
SMILESCC(=O)O.Fc1ccc2ccccc2c1
InChIInChI=1S/C10H7F.C2H4O2/c11-10-6-5-8-3-1-2-4-9(8)7-10;1-2(3)4/h1-7H;1H3,(H,3,4)
InChIKeyPBINNBLRUWCUIP-UHFFFAOYSA-N
MW206.22 g/mol
LogP3.07
Rot. Bonds

About acetic acid;2-fluoronaphthalene

acetic acid;2-fluoronaphthalene (PubChem CID 174506324) has the molecular formula C12H11FO2 and a molecular weight of 206.22 g/mol. Its IUPAC name is acetic acid;2-fluoronaphthalene.

Molecular Properties

Compound Nameacetic acid;2-fluoronaphthalene
PubChem CID174506324
Molecular FormulaC12H11FO2
Molecular Weight206.22 g/mol
Exact Mass206.07
IUPAC Nameacetic acid;2-fluoronaphthalene
SMILESCC(=O)O.Fc1ccc2ccccc2c1
InChIInChI=1S/C10H7F.C2H4O2/c11-10-6-5-8-3-1-2-4-9(8)7-10;1-2(3)4/h1-7H;1H3,(H,3,4)
InChIKeyPBINNBLRUWCUIP-UHFFFAOYSA-N
XLogP3.07
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.22
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of acetic acid;2-fluoronaphthalene?
The IUPAC name of acetic acid;2-fluoronaphthalene (CID 174506324) is acetic acid;2-fluoronaphthalene.
What is the SMILES notation for acetic acid;2-fluoronaphthalene?
The canonical SMILES for acetic acid;2-fluoronaphthalene is CC(=O)O.Fc1ccc2ccccc2c1.
What is the InChIKey of acetic acid;2-fluoronaphthalene?
The InChIKey is PBINNBLRUWCUIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F.C2H4O2/c11-10-6-5-8-3-1-2-4-9(8)7-10;1-2(3)4/h1-7H;1H3,(H,3,4).
What are the key properties of acetic acid;2-fluoronaphthalene?
acetic acid;2-fluoronaphthalene has a molecular weight of 206.22 g/mol, XLogP of 3.07, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for acetic acid;2-fluoronaphthalene is sourced from PubChem (CID 174506324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).