1-(2-bromoethenyl)naphthalene

C12H9Br — CID 71403351

IUPAC1-(2-bromoethenyl)naphthalene
SMILESBrC=Cc1cccc2ccccc12
InChIInChI=1S/C12H9Br/c13-9-8-11-6-3-5-10-4-1-2-7-12(10)11/h1-9H
InChIKeyCCWARAMLMHCSOW-UHFFFAOYSA-N
MW233.11 g/mol
LogP4.21
Rot. Bonds1

About 1-(2-bromoethenyl)naphthalene

1-(2-bromoethenyl)naphthalene (PubChem CID 71403351) has the molecular formula C12H9Br and a molecular weight of 233.11 g/mol. Its IUPAC name is 1-(2-bromoethenyl)naphthalene.

Molecular Properties

Compound Name1-(2-bromoethenyl)naphthalene
PubChem CID71403351
Molecular FormulaC12H9Br
Molecular Weight233.11 g/mol
Exact Mass231.99
IUPAC Name1-(2-bromoethenyl)naphthalene
SMILESBrC=Cc1cccc2ccccc12
InChIInChI=1S/C12H9Br/c13-9-8-11-6-3-5-10-4-1-2-7-12(10)11/h1-9H
InChIKeyCCWARAMLMHCSOW-UHFFFAOYSA-N
XLogP4.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.11
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-[2-[2,4,5-tris(2-naphthalen-1-ylethenyl)phenyl]ethenyl]naphthalene
CID 139835020
2-naphthalen-1-ylethenamine
CID 69243468
1-[(E)-2-[4-[(E)-2-naphthalen-1-ylethenyl]phenyl]ethenyl]naphthalene
CID 139196261
1-[2-[2-(2-phenylethenyl)phenyl]ethenyl]naphthalene
CID 71399192
N,N-dimethyl-2-naphthalen-1-ylethenamine
CID 139703260
9-(2-naphthalen-1-ylethenyl)anthracene
CID 630261
1-[(E)-but-1-en-3-ynyl]naphthalene
CID 12516867
(Z)-N,N-dimethyl-2-naphthalen-1-ylethenamine
CID 163840781
9-[(E)-2-naphthalen-1-ylethenyl]anthracene
CID 139205427
1-(2,2-dibromoethenyl)naphthalene
CID 12642645
4-[(E)-2-naphthalen-1-ylethenyl]naphthalen-1-ol
CID 139980470
naphthalene-1-carbaldehyde;zinc
CID 88790891

Frequently Asked Questions

What is the IUPAC name of 1-(2-bromoethenyl)naphthalene?
The IUPAC name of 1-(2-bromoethenyl)naphthalene (CID 71403351) is 1-(2-bromoethenyl)naphthalene.
What is the SMILES notation for 1-(2-bromoethenyl)naphthalene?
The canonical SMILES for 1-(2-bromoethenyl)naphthalene is BrC=Cc1cccc2ccccc12.
What is the InChIKey of 1-(2-bromoethenyl)naphthalene?
The InChIKey is CCWARAMLMHCSOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Br/c13-9-8-11-6-3-5-10-4-1-2-7-12(10)11/h1-9H.
What are the key properties of 1-(2-bromoethenyl)naphthalene?
1-(2-bromoethenyl)naphthalene has a molecular weight of 233.11 g/mol, XLogP of 4.21, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bromoethenyl)naphthalene is sourced from PubChem (CID 71403351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).