9,10-dihydrophenanthrene

C14H12 — CID 13058

IUPAC9,10-dihydrophenanthrene
SMILESc1ccc2c(c1)CCc1ccccc1-2
InChIInChI=1S/C14H12/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13/h1-8H,9-10H2
InChIKeyXXPBFNVKTVJZKF-UHFFFAOYSA-N
MW180.25 g/mol
LogP3.45
Rot. Bonds

About 9,10-dihydrophenanthrene

9,10-dihydrophenanthrene (PubChem CID 13058) has the molecular formula C14H12 and a molecular weight of 180.25 g/mol. Its IUPAC name is 9,10-dihydrophenanthrene.

Molecular Properties

Compound Name9,10-dihydrophenanthrene
PubChem CID13058
Molecular FormulaC14H12
Molecular Weight180.25 g/mol
Exact Mass180.09
IUPAC Name9,10-dihydrophenanthrene
SMILESc1ccc2c(c1)CCc1ccccc1-2
InChIInChI=1S/C14H12/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13/h1-8H,9-10H2
InChIKeyXXPBFNVKTVJZKF-UHFFFAOYSA-N
XLogP3.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 9,10-dihydrophenanthrene?
The IUPAC name of 9,10-dihydrophenanthrene (CID 13058) is 9,10-dihydrophenanthrene.
What is the SMILES notation for 9,10-dihydrophenanthrene?
The canonical SMILES for 9,10-dihydrophenanthrene is c1ccc2c(c1)CCc1ccccc1-2.
What is the InChIKey of 9,10-dihydrophenanthrene?
The InChIKey is XXPBFNVKTVJZKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13/h1-8H,9-10H2.
What are the key properties of 9,10-dihydrophenanthrene?
9,10-dihydrophenanthrene has a molecular weight of 180.25 g/mol, XLogP of 3.45, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,10-dihydrophenanthrene is sourced from PubChem (CID 13058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).