(6Z)-2-bromo-6-ethylidene-5-methylidenecyclohexa-1,3-diene

C9H9Br — CID 155185206

IUPAC(6Z)-2-bromo-6-ethylidene-5-methylidenecyclohexa-1,3-diene
SMILESC=c1ccc(Br)c/c1=C/C
InChIInChI=1S/C9H9Br/c1-3-8-6-9(10)5-4-7(8)2/h3-6H,2H2,1H3/b8-3-
InChIKeyJVBIRWIUNSKNCU-BAQGIRSFSA-N
MW197.07 g/mol
LogP1.66
Rot. Bonds

About (6Z)-2-bromo-6-ethylidene-5-methylidenecyclohexa-1,3-diene

(6Z)-2-bromo-6-ethylidene-5-methylidenecyclohexa-1,3-diene (PubChem CID 155185206) has the molecular formula C9H9Br and a molecular weight of 197.07 g/mol. Its IUPAC name is (6Z)-2-bromo-6-ethylidene-5-methylidenecyclohexa-1,3-diene.

Molecular Properties

Compound Name(6Z)-2-bromo-6-ethylidene-5-methylidenecyclohexa-1,3-diene
PubChem CID155185206
Molecular FormulaC9H9Br
Molecular Weight197.07 g/mol
Exact Mass195.99
IUPAC Name(6Z)-2-bromo-6-ethylidene-5-methylidenecyclohexa-1,3-diene
SMILESC=c1ccc(Br)c/c1=C/C
InChIInChI=1S/C9H9Br/c1-3-8-6-9(10)5-4-7(8)2/h3-6H,2H2,1H3/b8-3-
InChIKeyJVBIRWIUNSKNCU-BAQGIRSFSA-N
XLogP1.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.07
LogP ≤ 51.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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2,6-dibromonaphthalene
CID 640591
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CID 144567617
5-bromo-2-(4-bromo-2-formylphenyl)benzaldehyde
CID 11326094
1,2,7-tribromonaphthalene
CID 150191333
2-bromo-7-methyl-9-methylidenefluorene
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CID 159947245

Frequently Asked Questions

What is the IUPAC name of (6Z)-2-bromo-6-ethylidene-5-methylidenecyclohexa-1,3-diene?
The IUPAC name of (6Z)-2-bromo-6-ethylidene-5-methylidenecyclohexa-1,3-diene (CID 155185206) is (6Z)-2-bromo-6-ethylidene-5-methylidenecyclohexa-1,3-diene.
What is the SMILES notation for (6Z)-2-bromo-6-ethylidene-5-methylidenecyclohexa-1,3-diene?
The canonical SMILES for (6Z)-2-bromo-6-ethylidene-5-methylidenecyclohexa-1,3-diene is C=c1ccc(Br)c/c1=C/C.
What is the InChIKey of (6Z)-2-bromo-6-ethylidene-5-methylidenecyclohexa-1,3-diene?
The InChIKey is JVBIRWIUNSKNCU-BAQGIRSFSA-N. The full InChI is InChI=1S/C9H9Br/c1-3-8-6-9(10)5-4-7(8)2/h3-6H,2H2,1H3/b8-3-.
What are the key properties of (6Z)-2-bromo-6-ethylidene-5-methylidenecyclohexa-1,3-diene?
(6Z)-2-bromo-6-ethylidene-5-methylidenecyclohexa-1,3-diene has a molecular weight of 197.07 g/mol, XLogP of 1.66, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-2-bromo-6-ethylidene-5-methylidenecyclohexa-1,3-diene is sourced from PubChem (CID 155185206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).