8-bromo-6-fluoro-1,2,3,4-tetrahydronaphthalen-2-ol

C10H10BrFO — CID 58734223

IUPAC8-bromo-6-fluoro-1,2,3,4-tetrahydronaphthalen-2-ol
SMILESOC1CCc2cc(F)cc(Br)c2C1
InChIInChI=1S/C10H10BrFO/c11-10-4-7(12)3-6-1-2-8(13)5-9(6)10/h3-4,8,13H,1-2,5H2
InChIKeyUFQOXJFOVJTHPQ-UHFFFAOYSA-N
MW245.09 g/mol
LogP2.44
Rot. Bonds

About 8-bromo-6-fluoro-1,2,3,4-tetrahydronaphthalen-2-ol

8-bromo-6-fluoro-1,2,3,4-tetrahydronaphthalen-2-ol (PubChem CID 58734223) has the molecular formula C10H10BrFO and a molecular weight of 245.09 g/mol. Its IUPAC name is 8-bromo-6-fluoro-1,2,3,4-tetrahydronaphthalen-2-ol.

Molecular Properties

Compound Name8-bromo-6-fluoro-1,2,3,4-tetrahydronaphthalen-2-ol
PubChem CID58734223
Molecular FormulaC10H10BrFO
Molecular Weight245.09 g/mol
Exact Mass243.99
IUPAC Name8-bromo-6-fluoro-1,2,3,4-tetrahydronaphthalen-2-ol
SMILESOC1CCc2cc(F)cc(Br)c2C1
InChIInChI=1S/C10H10BrFO/c11-10-4-7(12)3-6-1-2-8(13)5-9(6)10/h3-4,8,13H,1-2,5H2
InChIKeyUFQOXJFOVJTHPQ-UHFFFAOYSA-N
XLogP2.44
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.09
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 8-bromo-6-fluoro-1,2,3,4-tetrahydronaphthalen-2-ol?
The IUPAC name of 8-bromo-6-fluoro-1,2,3,4-tetrahydronaphthalen-2-ol (CID 58734223) is 8-bromo-6-fluoro-1,2,3,4-tetrahydronaphthalen-2-ol.
What is the SMILES notation for 8-bromo-6-fluoro-1,2,3,4-tetrahydronaphthalen-2-ol?
The canonical SMILES for 8-bromo-6-fluoro-1,2,3,4-tetrahydronaphthalen-2-ol is OC1CCc2cc(F)cc(Br)c2C1.
What is the InChIKey of 8-bromo-6-fluoro-1,2,3,4-tetrahydronaphthalen-2-ol?
The InChIKey is UFQOXJFOVJTHPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrFO/c11-10-4-7(12)3-6-1-2-8(13)5-9(6)10/h3-4,8,13H,1-2,5H2.
What are the key properties of 8-bromo-6-fluoro-1,2,3,4-tetrahydronaphthalen-2-ol?
8-bromo-6-fluoro-1,2,3,4-tetrahydronaphthalen-2-ol has a molecular weight of 245.09 g/mol, XLogP of 2.44, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-6-fluoro-1,2,3,4-tetrahydronaphthalen-2-ol is sourced from PubChem (CID 58734223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).