7H-cyclopenta[b]phenanthrene

C17H12 — CID 134821266

IUPAC7H-cyclopenta[b]phenanthrene
SMILESC1=CC2=Cc3c(ccc4ccccc34)CC2=C1
InChIInChI=1S/C17H12/c1-2-7-16-12(4-1)8-9-15-10-13-5-3-6-14(13)11-17(15)16/h1-9,11H,10H2
InChIKeyTZOITUWEDCCLKX-UHFFFAOYSA-N
MW216.28 g/mol
LogP4.28
Rot. Bonds

About 7H-cyclopenta[b]phenanthrene

7H-cyclopenta[b]phenanthrene (PubChem CID 134821266) has the molecular formula C17H12 and a molecular weight of 216.28 g/mol. Its IUPAC name is 7H-cyclopenta[b]phenanthrene.

Molecular Properties

Compound Name7H-cyclopenta[b]phenanthrene
PubChem CID134821266
Molecular FormulaC17H12
Molecular Weight216.28 g/mol
Exact Mass216.09
IUPAC Name7H-cyclopenta[b]phenanthrene
SMILESC1=CC2=Cc3c(ccc4ccccc34)CC2=C1
InChIInChI=1S/C17H12/c1-2-7-16-12(4-1)8-9-15-10-13-5-3-6-14(13)11-17(15)16/h1-9,11H,10H2
InChIKeyTZOITUWEDCCLKX-UHFFFAOYSA-N
XLogP4.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 7H-cyclopenta[b]phenanthrene?
The IUPAC name of 7H-cyclopenta[b]phenanthrene (CID 134821266) is 7H-cyclopenta[b]phenanthrene.
What is the SMILES notation for 7H-cyclopenta[b]phenanthrene?
The canonical SMILES for 7H-cyclopenta[b]phenanthrene is C1=CC2=Cc3c(ccc4ccccc34)CC2=C1.
What is the InChIKey of 7H-cyclopenta[b]phenanthrene?
The InChIKey is TZOITUWEDCCLKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12/c1-2-7-16-12(4-1)8-9-15-10-13-5-3-6-14(13)11-17(15)16/h1-9,11H,10H2.
What are the key properties of 7H-cyclopenta[b]phenanthrene?
7H-cyclopenta[b]phenanthrene has a molecular weight of 216.28 g/mol, XLogP of 4.28, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7H-cyclopenta[b]phenanthrene is sourced from PubChem (CID 134821266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).