2-bromonaphthalen-1-ol;methoxymethane

C12H13BrO2 — CID 174734204

IUPAC2-bromonaphthalen-1-ol;methoxymethane
SMILESCOC.Oc1c(Br)ccc2ccccc12
InChIInChI=1S/C10H7BrO.C2H6O/c11-9-6-5-7-3-1-2-4-8(7)10(9)12;1-3-2/h1-6,12H;1-2H3
InChIKeyFSYLLQNPHKOMCQ-UHFFFAOYSA-N
MW269.14 g/mol
LogP3.57
Rot. Bonds

About 2-bromonaphthalen-1-ol;methoxymethane

2-bromonaphthalen-1-ol;methoxymethane (PubChem CID 174734204) has the molecular formula C12H13BrO2 and a molecular weight of 269.14 g/mol. Its IUPAC name is 2-bromonaphthalen-1-ol;methoxymethane.

Molecular Properties

Compound Name2-bromonaphthalen-1-ol;methoxymethane
PubChem CID174734204
Molecular FormulaC12H13BrO2
Molecular Weight269.14 g/mol
Exact Mass268.01
IUPAC Name2-bromonaphthalen-1-ol;methoxymethane
SMILESCOC.Oc1c(Br)ccc2ccccc12
InChIInChI=1S/C10H7BrO.C2H6O/c11-9-6-5-7-3-1-2-4-8(7)10(9)12;1-3-2/h1-6,12H;1-2H3
InChIKeyFSYLLQNPHKOMCQ-UHFFFAOYSA-N
XLogP3.57
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.14
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane
CID 20848816
naphthalene-1,2-diol;naphthalene-1,4-diol
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7-bromo-6-methoxybenzo[7]annulen-5-one
CID 121010887
2-[(4-bromophenyl)methyl]naphthalen-1-ol
CID 15617869
2-aminonaphthalen-1-ol;ethane
CID 143085377
2-(1-bromoethyl)naphthalen-1-ol
CID 140980182
2-(2-bromonaphthalen-1-yl)phenol
CID 122642120
2-bromonaphthalen-1-amine
CID 10889478
2-propan-2-yloxynaphthalen-1-ol
CID 23272530
2-bromobenzo[a]anthracen-1-ol
CID 88522900
2-bromo-7-chloronaphthalen-1-ol
CID 82275045
2-[(2-methoxyphenyl)methyl]naphthalen-1-ol
CID 15617840

Frequently Asked Questions

What is the IUPAC name of 2-bromonaphthalen-1-ol;methoxymethane?
The IUPAC name of 2-bromonaphthalen-1-ol;methoxymethane (CID 174734204) is 2-bromonaphthalen-1-ol;methoxymethane.
What is the SMILES notation for 2-bromonaphthalen-1-ol;methoxymethane?
The canonical SMILES for 2-bromonaphthalen-1-ol;methoxymethane is COC.Oc1c(Br)ccc2ccccc12.
What is the InChIKey of 2-bromonaphthalen-1-ol;methoxymethane?
The InChIKey is FSYLLQNPHKOMCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrO.C2H6O/c11-9-6-5-7-3-1-2-4-8(7)10(9)12;1-3-2/h1-6,12H;1-2H3.
What are the key properties of 2-bromonaphthalen-1-ol;methoxymethane?
2-bromonaphthalen-1-ol;methoxymethane has a molecular weight of 269.14 g/mol, XLogP of 3.57, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromonaphthalen-1-ol;methoxymethane is sourced from PubChem (CID 174734204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).