(5Z,7Z)-4-methylidenebicyclo[8.2.0]dodeca-1(10),2,5,7-tetraene

C13H14 — CID 174278772

IUPAC(5Z,7Z)-4-methylidenebicyclo[8.2.0]dodeca-1(10),2,5,7-tetraene
SMILESC=C1C=CC2=C(C/C=C\C=C/1)CC2
InChIInChI=1S/C13H14/c1-11-5-3-2-4-6-12-9-10-13(12)8-7-11/h2-5,7-8H,1,6,9-10H2/b4-2-,5-3-,8-7?
InChIKeyWMOUZEUVASJJHV-HQFFKWLDSA-N
MW170.25 g/mol
LogP3.71
Rot. Bonds

About (5Z,7Z)-4-methylidenebicyclo[8.2.0]dodeca-1(10),2,5,7-tetraene

(5Z,7Z)-4-methylidenebicyclo[8.2.0]dodeca-1(10),2,5,7-tetraene (PubChem CID 174278772) has the molecular formula C13H14 and a molecular weight of 170.25 g/mol. Its IUPAC name is (5Z,7Z)-4-methylidenebicyclo[8.2.0]dodeca-1(10),2,5,7-tetraene.

Molecular Properties

Compound Name(5Z,7Z)-4-methylidenebicyclo[8.2.0]dodeca-1(10),2,5,7-tetraene
PubChem CID174278772
Molecular FormulaC13H14
Molecular Weight170.25 g/mol
Exact Mass170.11
IUPAC Name(5Z,7Z)-4-methylidenebicyclo[8.2.0]dodeca-1(10),2,5,7-tetraene
SMILESC=C1C=CC2=C(C/C=C\C=C/1)CC2
InChIInChI=1S/C13H14/c1-11-5-3-2-4-6-12-9-10-13(12)8-7-11/h2-5,7-8H,1,6,9-10H2/b4-2-,5-3-,8-7?
InChIKeyWMOUZEUVASJJHV-HQFFKWLDSA-N
XLogP3.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (5Z,7Z)-4-methylidenebicyclo[8.2.0]dodeca-1(10),2,5,7-tetraene?
The IUPAC name of (5Z,7Z)-4-methylidenebicyclo[8.2.0]dodeca-1(10),2,5,7-tetraene (CID 174278772) is (5Z,7Z)-4-methylidenebicyclo[8.2.0]dodeca-1(10),2,5,7-tetraene.
What is the SMILES notation for (5Z,7Z)-4-methylidenebicyclo[8.2.0]dodeca-1(10),2,5,7-tetraene?
The canonical SMILES for (5Z,7Z)-4-methylidenebicyclo[8.2.0]dodeca-1(10),2,5,7-tetraene is C=C1C=CC2=C(C/C=C\C=C/1)CC2.
What is the InChIKey of (5Z,7Z)-4-methylidenebicyclo[8.2.0]dodeca-1(10),2,5,7-tetraene?
The InChIKey is WMOUZEUVASJJHV-HQFFKWLDSA-N. The full InChI is InChI=1S/C13H14/c1-11-5-3-2-4-6-12-9-10-13(12)8-7-11/h2-5,7-8H,1,6,9-10H2/b4-2-,5-3-,8-7?.
What are the key properties of (5Z,7Z)-4-methylidenebicyclo[8.2.0]dodeca-1(10),2,5,7-tetraene?
(5Z,7Z)-4-methylidenebicyclo[8.2.0]dodeca-1(10),2,5,7-tetraene has a molecular weight of 170.25 g/mol, XLogP of 3.71, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z,7Z)-4-methylidenebicyclo[8.2.0]dodeca-1(10),2,5,7-tetraene is sourced from PubChem (CID 174278772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).