9,10-dihydrophenanthrene;methane

C15H16 — CID 174728506

IUPAC9,10-dihydrophenanthrene;methane
SMILESC.c1ccc2c(c1)CCc1ccccc1-2
InChIInChI=1S/C14H12.CH4/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13;/h1-8H,9-10H2;1H4
InChIKeyPWTPVELFJMGGEQ-UHFFFAOYSA-N
MW196.29 g/mol
LogP4.09
Rot. Bonds

About 9,10-dihydrophenanthrene;methane

9,10-dihydrophenanthrene;methane (PubChem CID 174728506) has the molecular formula C15H16 and a molecular weight of 196.29 g/mol. Its IUPAC name is 9,10-dihydrophenanthrene;methane.

Molecular Properties

Compound Name9,10-dihydrophenanthrene;methane
PubChem CID174728506
Molecular FormulaC15H16
Molecular Weight196.29 g/mol
Exact Mass196.13
IUPAC Name9,10-dihydrophenanthrene;methane
SMILESC.c1ccc2c(c1)CCc1ccccc1-2
InChIInChI=1S/C14H12.CH4/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13;/h1-8H,9-10H2;1H4
InChIKeyPWTPVELFJMGGEQ-UHFFFAOYSA-N
XLogP4.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 9,10-dihydrophenanthrene;methane?
The IUPAC name of 9,10-dihydrophenanthrene;methane (CID 174728506) is 9,10-dihydrophenanthrene;methane.
What is the SMILES notation for 9,10-dihydrophenanthrene;methane?
The canonical SMILES for 9,10-dihydrophenanthrene;methane is C.c1ccc2c(c1)CCc1ccccc1-2.
What is the InChIKey of 9,10-dihydrophenanthrene;methane?
The InChIKey is PWTPVELFJMGGEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12.CH4/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13;/h1-8H,9-10H2;1H4.
What are the key properties of 9,10-dihydrophenanthrene;methane?
9,10-dihydrophenanthrene;methane has a molecular weight of 196.29 g/mol, XLogP of 4.09, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,10-dihydrophenanthrene;methane is sourced from PubChem (CID 174728506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).