hexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3,5,7,9,11,13,15,17,19,21,23-dodecaene

C24H14 — CID 21088003

IUPAChexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3,5,7,9,11,13,15,17,19,21,23-dodecaene
SMILESC1=c2ccccc2=c2cc3cc4c(cc3cc21)=c1ccccc1=C4
InChIInChI=1S/C24H14/c1-3-7-21-15(5-1)9-19-11-17-14-24-20(12-18(17)13-23(19)21)10-16-6-2-4-8-22(16)24/h1-14H
InChIKeyZCFDKGDAVQHTPR-UHFFFAOYSA-N
MW302.38 g/mol
LogP3.70
Rot. Bonds

About hexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3,5,7,9,11,13,15,17,19,21,23-dodecaene

hexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3,5,7,9,11,13,15,17,19,21,23-dodecaene (PubChem CID 21088003) has the molecular formula C24H14 and a molecular weight of 302.38 g/mol. Its IUPAC name is hexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3,5,7,9,11,13,15,17,19,21,23-dodecaene.

Molecular Properties

Compound Namehexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3,5,7,9,11,13,15,17,19,21,23-dodecaene
PubChem CID21088003
Molecular FormulaC24H14
Molecular Weight302.38 g/mol
Exact Mass302.11
IUPAC Namehexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3,5,7,9,11,13,15,17,19,21,23-dodecaene
SMILESC1=c2ccccc2=c2cc3cc4c(cc3cc21)=c1ccccc1=C4
InChIInChI=1S/C24H14/c1-3-7-21-15(5-1)9-19-11-17-14-24-20(12-18(17)13-23(19)21)10-16-6-2-4-8-22(16)24/h1-14H
InChIKeyZCFDKGDAVQHTPR-UHFFFAOYSA-N
XLogP3.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of hexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3,5,7,9,11,13,15,17,19,21,23-dodecaene?
The IUPAC name of hexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3,5,7,9,11,13,15,17,19,21,23-dodecaene (CID 21088003) is hexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3,5,7,9,11,13,15,17,19,21,23-dodecaene.
What is the SMILES notation for hexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3,5,7,9,11,13,15,17,19,21,23-dodecaene?
The canonical SMILES for hexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3,5,7,9,11,13,15,17,19,21,23-dodecaene is C1=c2ccccc2=c2cc3cc4c(cc3cc21)=c1ccccc1=C4.
What is the InChIKey of hexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3,5,7,9,11,13,15,17,19,21,23-dodecaene?
The InChIKey is ZCFDKGDAVQHTPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H14/c1-3-7-21-15(5-1)9-19-11-17-14-24-20(12-18(17)13-23(19)21)10-16-6-2-4-8-22(16)24/h1-14H.
What are the key properties of hexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3,5,7,9,11,13,15,17,19,21,23-dodecaene?
hexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3,5,7,9,11,13,15,17,19,21,23-dodecaene has a molecular weight of 302.38 g/mol, XLogP of 3.70, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3,5,7,9,11,13,15,17,19,21,23-dodecaene is sourced from PubChem (CID 21088003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).