(6Z)-2-bromo-5-methylidene-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)cyclohexa-1,3-diene

C14H11Br — CID 123461057

IUPAC(6Z)-2-bromo-5-methylidene-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)cyclohexa-1,3-diene
SMILESC=c1cccc/c1=c1\cc(Br)ccc1=C
InChIInChI=1S/C14H11Br/c1-10-5-3-4-6-13(10)14-9-12(15)8-7-11(14)2/h3-9H,1-2H2/b14-13-
InChIKeyDEDCZWRBQGMHAB-YPKPFQOOSA-N
MW259.15 g/mol
LogP2.56
Rot. Bonds

About (6Z)-2-bromo-5-methylidene-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)cyclohexa-1,3-diene

(6Z)-2-bromo-5-methylidene-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)cyclohexa-1,3-diene (PubChem CID 123461057) has the molecular formula C14H11Br and a molecular weight of 259.15 g/mol. Its IUPAC name is (6Z)-2-bromo-5-methylidene-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)cyclohexa-1,3-diene.

Molecular Properties

Compound Name(6Z)-2-bromo-5-methylidene-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)cyclohexa-1,3-diene
PubChem CID123461057
Molecular FormulaC14H11Br
Molecular Weight259.15 g/mol
Exact Mass258.00
IUPAC Name(6Z)-2-bromo-5-methylidene-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)cyclohexa-1,3-diene
SMILESC=c1cccc/c1=c1\cc(Br)ccc1=C
InChIInChI=1S/C14H11Br/c1-10-5-3-4-6-13(10)14-9-12(15)8-7-11(14)2/h3-9H,1-2H2/b14-13-
InChIKeyDEDCZWRBQGMHAB-YPKPFQOOSA-N
XLogP2.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.15
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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(6Z)-2-bromo-6-ethylidene-5-methylidenecyclohexa-1,3-diene
CID 155185206
2-bromonaphthalene;naphthalen-2-amine
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1,3-dibromobenzene;1,4-dibromobenzene
CID 70555684
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CID 142293502
1,3-dibromo(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene
CID 54590075
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CID 89197821
2-bromonaphthalene;sulfuryl dichloride
CID 174434762
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CID 68562751
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CID 15544767

Frequently Asked Questions

What is the IUPAC name of (6Z)-2-bromo-5-methylidene-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)cyclohexa-1,3-diene?
The IUPAC name of (6Z)-2-bromo-5-methylidene-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)cyclohexa-1,3-diene (CID 123461057) is (6Z)-2-bromo-5-methylidene-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)cyclohexa-1,3-diene.
What is the SMILES notation for (6Z)-2-bromo-5-methylidene-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)cyclohexa-1,3-diene?
The canonical SMILES for (6Z)-2-bromo-5-methylidene-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)cyclohexa-1,3-diene is C=c1cccc/c1=c1\cc(Br)ccc1=C.
What is the InChIKey of (6Z)-2-bromo-5-methylidene-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)cyclohexa-1,3-diene?
The InChIKey is DEDCZWRBQGMHAB-YPKPFQOOSA-N. The full InChI is InChI=1S/C14H11Br/c1-10-5-3-4-6-13(10)14-9-12(15)8-7-11(14)2/h3-9H,1-2H2/b14-13-.
What are the key properties of (6Z)-2-bromo-5-methylidene-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)cyclohexa-1,3-diene?
(6Z)-2-bromo-5-methylidene-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)cyclohexa-1,3-diene has a molecular weight of 259.15 g/mol, XLogP of 2.56, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-2-bromo-5-methylidene-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)cyclohexa-1,3-diene is sourced from PubChem (CID 123461057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).