3-ethyl-2,3-dihydrophenanthrene

C16H16 — CID 174946736

IUPAC3-ethyl-2,3-dihydrophenanthrene
SMILESCCC1C=c2c(ccc3ccccc23)=CC1
InChIInChI=1S/C16H16/c1-2-12-7-8-14-10-9-13-5-3-4-6-15(13)16(14)11-12/h3-6,8-12H,2,7H2,1H3
InChIKeyUPQVIZXAEXKFMY-UHFFFAOYSA-N
MW208.30 g/mol
LogP2.83
Rot. Bonds1

About 3-ethyl-2,3-dihydrophenanthrene

3-ethyl-2,3-dihydrophenanthrene (PubChem CID 174946736) has the molecular formula C16H16 and a molecular weight of 208.30 g/mol. Its IUPAC name is 3-ethyl-2,3-dihydrophenanthrene.

Molecular Properties

Compound Name3-ethyl-2,3-dihydrophenanthrene
PubChem CID174946736
Molecular FormulaC16H16
Molecular Weight208.30 g/mol
Exact Mass208.13
IUPAC Name3-ethyl-2,3-dihydrophenanthrene
SMILESCCC1C=c2c(ccc3ccccc23)=CC1
InChIInChI=1S/C16H16/c1-2-12-7-8-14-10-9-13-5-3-4-6-15(13)16(14)11-12/h3-6,8-12H,2,7H2,1H3
InChIKeyUPQVIZXAEXKFMY-UHFFFAOYSA-N
XLogP2.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2,3-dihydrophenanthrene?
The IUPAC name of 3-ethyl-2,3-dihydrophenanthrene (CID 174946736) is 3-ethyl-2,3-dihydrophenanthrene.
What is the SMILES notation for 3-ethyl-2,3-dihydrophenanthrene?
The canonical SMILES for 3-ethyl-2,3-dihydrophenanthrene is CCC1C=c2c(ccc3ccccc23)=CC1.
What is the InChIKey of 3-ethyl-2,3-dihydrophenanthrene?
The InChIKey is UPQVIZXAEXKFMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16/c1-2-12-7-8-14-10-9-13-5-3-4-6-15(13)16(14)11-12/h3-6,8-12H,2,7H2,1H3.
What are the key properties of 3-ethyl-2,3-dihydrophenanthrene?
3-ethyl-2,3-dihydrophenanthrene has a molecular weight of 208.30 g/mol, XLogP of 2.83, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2,3-dihydrophenanthrene is sourced from PubChem (CID 174946736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).