(5Z,7Z,9Z,11Z)-cyclododeca-1,2,3,5,7,9,11-heptaene

C12H10 — CID 177450332

IUPAC(5Z,7Z,9Z,11Z)-cyclododeca-1,2,3,5,7,9,11-heptaene
SMILESC1=C=C/C=C\C=C/C=C\C=C/C=1
InChIInChI=1S/C12H10/c1-2-4-6-8-10-12-11-9-7-5-3-1/h1-10H/b2-1-,3-1-,4-2-,5-3-,6-4-,7-5-,8-6-,9-7-,10-8-
InChIKeyWPMTXTYKGNGPGD-LSZYUINMSA-N
MW154.21 g/mol
LogP3.09
Rot. Bonds

About (5Z,7Z,9Z,11Z)-cyclododeca-1,2,3,5,7,9,11-heptaene

(5Z,7Z,9Z,11Z)-cyclododeca-1,2,3,5,7,9,11-heptaene (PubChem CID 177450332) has the molecular formula C12H10 and a molecular weight of 154.21 g/mol. Its IUPAC name is (5Z,7Z,9Z,11Z)-cyclododeca-1,2,3,5,7,9,11-heptaene.

Molecular Properties

Compound Name(5Z,7Z,9Z,11Z)-cyclododeca-1,2,3,5,7,9,11-heptaene
PubChem CID177450332
Molecular FormulaC12H10
Molecular Weight154.21 g/mol
Exact Mass154.08
IUPAC Name(5Z,7Z,9Z,11Z)-cyclododeca-1,2,3,5,7,9,11-heptaene
SMILESC1=C=C/C=C\C=C/C=C\C=C/C=1
InChIInChI=1S/C12H10/c1-2-4-6-8-10-12-11-9-7-5-3-1/h1-10H/b2-1-,3-1-,4-2-,5-3-,6-4-,7-5-,8-6-,9-7-,10-8-
InChIKeyWPMTXTYKGNGPGD-LSZYUINMSA-N
XLogP3.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (5Z,7Z,9Z,11Z)-cyclododeca-1,2,3,5,7,9,11-heptaene?
The IUPAC name of (5Z,7Z,9Z,11Z)-cyclododeca-1,2,3,5,7,9,11-heptaene (CID 177450332) is (5Z,7Z,9Z,11Z)-cyclododeca-1,2,3,5,7,9,11-heptaene.
What is the SMILES notation for (5Z,7Z,9Z,11Z)-cyclododeca-1,2,3,5,7,9,11-heptaene?
The canonical SMILES for (5Z,7Z,9Z,11Z)-cyclododeca-1,2,3,5,7,9,11-heptaene is C1=C=C/C=C\C=C/C=C\C=C/C=1.
What is the InChIKey of (5Z,7Z,9Z,11Z)-cyclododeca-1,2,3,5,7,9,11-heptaene?
The InChIKey is WPMTXTYKGNGPGD-LSZYUINMSA-N. The full InChI is InChI=1S/C12H10/c1-2-4-6-8-10-12-11-9-7-5-3-1/h1-10H/b2-1-,3-1-,4-2-,5-3-,6-4-,7-5-,8-6-,9-7-,10-8-.
What are the key properties of (5Z,7Z,9Z,11Z)-cyclododeca-1,2,3,5,7,9,11-heptaene?
(5Z,7Z,9Z,11Z)-cyclododeca-1,2,3,5,7,9,11-heptaene has a molecular weight of 154.21 g/mol, XLogP of 3.09, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z,7Z,9Z,11Z)-cyclododeca-1,2,3,5,7,9,11-heptaene is sourced from PubChem (CID 177450332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).