8-fluorospiro[2,3-dihydro-1H-naphthalene-4,2'-oxetane]

C12H13FO — CID 84619079

IUPAC8-fluorospiro[2,3-dihydro-1H-naphthalene-4,2'-oxetane]
SMILESFc1cccc2c1CCCC21CCO1
InChIInChI=1S/C12H13FO/c13-11-5-1-4-10-9(11)3-2-6-12(10)7-8-14-12/h1,4-5H,2-3,6-8H2
InChIKeyIVMXUIUQSLELIW-UHFFFAOYSA-N
MW192.23 g/mol
LogP2.78
Rot. Bonds

About 8-fluorospiro[2,3-dihydro-1H-naphthalene-4,2'-oxetane]

8-fluorospiro[2,3-dihydro-1H-naphthalene-4,2'-oxetane] (PubChem CID 84619079) has the molecular formula C12H13FO and a molecular weight of 192.23 g/mol. Its IUPAC name is 8-fluorospiro[2,3-dihydro-1H-naphthalene-4,2'-oxetane].

Molecular Properties

Compound Name8-fluorospiro[2,3-dihydro-1H-naphthalene-4,2'-oxetane]
PubChem CID84619079
Molecular FormulaC12H13FO
Molecular Weight192.23 g/mol
Exact Mass192.10
IUPAC Name8-fluorospiro[2,3-dihydro-1H-naphthalene-4,2'-oxetane]
SMILESFc1cccc2c1CCCC21CCO1
InChIInChI=1S/C12H13FO/c13-11-5-1-4-10-9(11)3-2-6-12(10)7-8-14-12/h1,4-5H,2-3,6-8H2
InChIKeyIVMXUIUQSLELIW-UHFFFAOYSA-N
XLogP2.78
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.23
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4,4,8-trifluoro-2,3-dihydro-1H-naphthalene
CID 84718996
7-methylspiro[1,2-dihydroindene-3,2'-oxetane]
CID 84618324
ethane;8-fluoro-4-methyl-4-propan-2-yl-2,3-dihydro-1H-naphthalene
CID 176568525
(4S)-8'-fluorospiro[1,3-oxazolidine-4,4'-2,3-dihydro-1H-naphthalene]-2-one
CID 166499768
8-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-oxirane]
CID 13270870
5-fluoro-1-(methoxymethyl)-3,4-dihydro-2H-naphthalen-1-ol
CID 105464045
spiro[1,2-dihydroindene-3,2'-oxetane]
CID 84618292
5-fluorospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopentane]-2-amine
CID 115057113
(1-ethenyl-5-fluoro-3,4-dihydro-2H-naphthalen-1-yl) 2-methylprop-2-enoate
CID 89475199
4-fluoro-1-(oxolan-2-ylmethylamino)-2,3-dihydroindene-1-carboxamide
CID 83066162
(1-ethynyl-5-fluoro-3,4-dihydro-2H-naphthalen-1-yl) 2-methylprop-2-enoate
CID 89475194
5-fluorospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclohexane]-2-ol
CID 115010849

Frequently Asked Questions

What is the IUPAC name of 8-fluorospiro[2,3-dihydro-1H-naphthalene-4,2'-oxetane]?
The IUPAC name of 8-fluorospiro[2,3-dihydro-1H-naphthalene-4,2'-oxetane] (CID 84619079) is 8-fluorospiro[2,3-dihydro-1H-naphthalene-4,2'-oxetane].
What is the SMILES notation for 8-fluorospiro[2,3-dihydro-1H-naphthalene-4,2'-oxetane]?
The canonical SMILES for 8-fluorospiro[2,3-dihydro-1H-naphthalene-4,2'-oxetane] is Fc1cccc2c1CCCC21CCO1.
What is the InChIKey of 8-fluorospiro[2,3-dihydro-1H-naphthalene-4,2'-oxetane]?
The InChIKey is IVMXUIUQSLELIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13FO/c13-11-5-1-4-10-9(11)3-2-6-12(10)7-8-14-12/h1,4-5H,2-3,6-8H2.
What are the key properties of 8-fluorospiro[2,3-dihydro-1H-naphthalene-4,2'-oxetane]?
8-fluorospiro[2,3-dihydro-1H-naphthalene-4,2'-oxetane] has a molecular weight of 192.23 g/mol, XLogP of 2.78, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluorospiro[2,3-dihydro-1H-naphthalene-4,2'-oxetane] is sourced from PubChem (CID 84619079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).