[(Z)-2-bromoethenyl]benzene

C8H7Br — CID 5369379

IUPAC[(Z)-2-bromoethenyl]benzene
SMILESBr/C=C\c1ccccc1
InChIInChI=1S/C8H7Br/c9-7-6-8-4-2-1-3-5-8/h1-7H/b7-6-
InChIKeyYMOONIIMQBGTDU-SREVYHEPSA-N
MW183.05 g/mol
LogP3.05
Rot. Bonds1

About [(Z)-2-bromoethenyl]benzene

[(Z)-2-bromoethenyl]benzene (PubChem CID 5369379) has the molecular formula C8H7Br and a molecular weight of 183.05 g/mol. Its IUPAC name is [(Z)-2-bromoethenyl]benzene.

Molecular Properties

Compound Name[(Z)-2-bromoethenyl]benzene
PubChem CID5369379
Molecular FormulaC8H7Br
Molecular Weight183.05 g/mol
Exact Mass181.97
IUPAC Name[(Z)-2-bromoethenyl]benzene
SMILESBr/C=C\c1ccccc1
InChIInChI=1S/C8H7Br/c9-7-6-8-4-2-1-3-5-8/h1-7H/b7-6-
InChIKeyYMOONIIMQBGTDU-SREVYHEPSA-N
XLogP3.05
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.05
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of [(Z)-2-bromoethenyl]benzene?
The IUPAC name of [(Z)-2-bromoethenyl]benzene (CID 5369379) is [(Z)-2-bromoethenyl]benzene.
What is the SMILES notation for [(Z)-2-bromoethenyl]benzene?
The canonical SMILES for [(Z)-2-bromoethenyl]benzene is Br/C=C\c1ccccc1.
What is the InChIKey of [(Z)-2-bromoethenyl]benzene?
The InChIKey is YMOONIIMQBGTDU-SREVYHEPSA-N. The full InChI is InChI=1S/C8H7Br/c9-7-6-8-4-2-1-3-5-8/h1-7H/b7-6-.
What are the key properties of [(Z)-2-bromoethenyl]benzene?
[(Z)-2-bromoethenyl]benzene has a molecular weight of 183.05 g/mol, XLogP of 3.05, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-2-bromoethenyl]benzene is sourced from PubChem (CID 5369379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).