2-(bromomethyl)-6-ethenylnaphthalene

C13H11Br — CID 139944485

IUPAC2-(bromomethyl)-6-ethenylnaphthalene
SMILESC=Cc1ccc2cc(CBr)ccc2c1
InChIInChI=1S/C13H11Br/c1-2-10-3-5-13-8-11(9-14)4-6-12(13)7-10/h2-8H,1,9H2
InChIKeyCBGGYCPCKBTZKV-UHFFFAOYSA-N
MW247.13 g/mol
LogP4.38
Rot. Bonds2

About 2-(bromomethyl)-6-ethenylnaphthalene

2-(bromomethyl)-6-ethenylnaphthalene (PubChem CID 139944485) has the molecular formula C13H11Br and a molecular weight of 247.13 g/mol. Its IUPAC name is 2-(bromomethyl)-6-ethenylnaphthalene.

Molecular Properties

Compound Name2-(bromomethyl)-6-ethenylnaphthalene
PubChem CID139944485
Molecular FormulaC13H11Br
Molecular Weight247.13 g/mol
Exact Mass246.00
IUPAC Name2-(bromomethyl)-6-ethenylnaphthalene
SMILESC=Cc1ccc2cc(CBr)ccc2c1
InChIInChI=1S/C13H11Br/c1-2-10-3-5-13-8-11(9-14)4-6-12(13)7-10/h2-8H,1,9H2
InChIKeyCBGGYCPCKBTZKV-UHFFFAOYSA-N
XLogP4.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.13
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

2-(6-ethenylnaphthalen-2-yl)ethylsilane
CID 158173365
2,6-bis(ethenyl)anthracene
CID 102227749
2-(bromomethyl)naphthalene;hydrobromide
CID 158623865
1-(bromomethyl)-4-[(4-ethenylphenyl)methoxy]benzene
CID 4686859
1-(bromomethyl)-7-ethenylnaphthalene
CID 139944497
2-(bromomethyl)-4-ethenyl-1-methylbenzene
CID 139992255
1-ethenyl-4-[[4-[[4-[(4-ethenylphenyl)methyl]phenyl]methyl]phenyl]methyl]benzene
CID 163649628
1,4-bis[(4-ethenylphenyl)methyl]benzene
CID 20738932
2-(bromomethyl)-7-methylnaphthalene
CID 13426568
7-(bromomethyl)naphthalen-2-amine
CID 118999524
2-chloro-7-ethenylnaphthalene
CID 135395859
2-(bromomethyl)-7-fluoronaphthalene
CID 23292295

Frequently Asked Questions

What is the IUPAC name of 2-(bromomethyl)-6-ethenylnaphthalene?
The IUPAC name of 2-(bromomethyl)-6-ethenylnaphthalene (CID 139944485) is 2-(bromomethyl)-6-ethenylnaphthalene.
What is the SMILES notation for 2-(bromomethyl)-6-ethenylnaphthalene?
The canonical SMILES for 2-(bromomethyl)-6-ethenylnaphthalene is C=Cc1ccc2cc(CBr)ccc2c1.
What is the InChIKey of 2-(bromomethyl)-6-ethenylnaphthalene?
The InChIKey is CBGGYCPCKBTZKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11Br/c1-2-10-3-5-13-8-11(9-14)4-6-12(13)7-10/h2-8H,1,9H2.
What are the key properties of 2-(bromomethyl)-6-ethenylnaphthalene?
2-(bromomethyl)-6-ethenylnaphthalene has a molecular weight of 247.13 g/mol, XLogP of 4.38, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(bromomethyl)-6-ethenylnaphthalene is sourced from PubChem (CID 139944485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).