6-bromo-2-methyl-3,4-dihydro-1H-naphthalen-2-ol

C11H13BrO — CID 63632554

IUPAC6-bromo-2-methyl-3,4-dihydro-1H-naphthalen-2-ol
SMILESCC1(O)CCc2cc(Br)ccc2C1
InChIInChI=1S/C11H13BrO/c1-11(13)5-4-8-6-10(12)3-2-9(8)7-11/h2-3,6,13H,4-5,7H2,1H3
InChIKeyXVFPOIIFLDVICE-UHFFFAOYSA-N
MW241.13 g/mol
LogP2.69
Rot. Bonds

About 6-bromo-2-methyl-3,4-dihydro-1H-naphthalen-2-ol

6-bromo-2-methyl-3,4-dihydro-1H-naphthalen-2-ol (PubChem CID 63632554) has the molecular formula C11H13BrO and a molecular weight of 241.13 g/mol. Its IUPAC name is 6-bromo-2-methyl-3,4-dihydro-1H-naphthalen-2-ol.

Molecular Properties

Compound Name6-bromo-2-methyl-3,4-dihydro-1H-naphthalen-2-ol
PubChem CID63632554
Molecular FormulaC11H13BrO
Molecular Weight241.13 g/mol
Exact Mass240.01
IUPAC Name6-bromo-2-methyl-3,4-dihydro-1H-naphthalen-2-ol
SMILESCC1(O)CCc2cc(Br)ccc2C1
InChIInChI=1S/C11H13BrO/c1-11(13)5-4-8-6-10(12)3-2-9(8)7-11/h2-3,6,13H,4-5,7H2,1H3
InChIKeyXVFPOIIFLDVICE-UHFFFAOYSA-N
XLogP2.69
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.13
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-methyl-3,4-dihydro-1H-naphthalen-2-ol?
The IUPAC name of 6-bromo-2-methyl-3,4-dihydro-1H-naphthalen-2-ol (CID 63632554) is 6-bromo-2-methyl-3,4-dihydro-1H-naphthalen-2-ol.
What is the SMILES notation for 6-bromo-2-methyl-3,4-dihydro-1H-naphthalen-2-ol?
The canonical SMILES for 6-bromo-2-methyl-3,4-dihydro-1H-naphthalen-2-ol is CC1(O)CCc2cc(Br)ccc2C1.
What is the InChIKey of 6-bromo-2-methyl-3,4-dihydro-1H-naphthalen-2-ol?
The InChIKey is XVFPOIIFLDVICE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13BrO/c1-11(13)5-4-8-6-10(12)3-2-9(8)7-11/h2-3,6,13H,4-5,7H2,1H3.
What are the key properties of 6-bromo-2-methyl-3,4-dihydro-1H-naphthalen-2-ol?
6-bromo-2-methyl-3,4-dihydro-1H-naphthalen-2-ol has a molecular weight of 241.13 g/mol, XLogP of 2.69, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-methyl-3,4-dihydro-1H-naphthalen-2-ol is sourced from PubChem (CID 63632554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).