7-ethyl-1,2,3,8-tetramethylnaphthalene

C16H20 — CID 162292672

IUPAC7-ethyl-1,2,3,8-tetramethylnaphthalene
SMILESCCc1ccc2cc(C)c(C)c(C)c2c1C
InChIInChI=1S/C16H20/c1-6-14-7-8-15-9-10(2)11(3)12(4)16(15)13(14)5/h7-9H,6H2,1-5H3
InChIKeyXUMPYPYLBJWWNE-UHFFFAOYSA-N
MW212.34 g/mol
LogP4.64
Rot. Bonds1

About 7-ethyl-1,2,3,8-tetramethylnaphthalene

7-ethyl-1,2,3,8-tetramethylnaphthalene (PubChem CID 162292672) has the molecular formula C16H20 and a molecular weight of 212.34 g/mol. Its IUPAC name is 7-ethyl-1,2,3,8-tetramethylnaphthalene.

Molecular Properties

Compound Name7-ethyl-1,2,3,8-tetramethylnaphthalene
PubChem CID162292672
Molecular FormulaC16H20
Molecular Weight212.34 g/mol
Exact Mass212.16
IUPAC Name7-ethyl-1,2,3,8-tetramethylnaphthalene
SMILESCCc1ccc2cc(C)c(C)c(C)c2c1C
InChIInChI=1S/C16H20/c1-6-14-7-8-15-9-10(2)11(3)12(4)16(15)13(14)5/h7-9H,6H2,1-5H3
InChIKeyXUMPYPYLBJWWNE-UHFFFAOYSA-N
XLogP4.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 7-ethyl-1,2,3,8-tetramethylnaphthalene?
The IUPAC name of 7-ethyl-1,2,3,8-tetramethylnaphthalene (CID 162292672) is 7-ethyl-1,2,3,8-tetramethylnaphthalene.
What is the SMILES notation for 7-ethyl-1,2,3,8-tetramethylnaphthalene?
The canonical SMILES for 7-ethyl-1,2,3,8-tetramethylnaphthalene is CCc1ccc2cc(C)c(C)c(C)c2c1C.
What is the InChIKey of 7-ethyl-1,2,3,8-tetramethylnaphthalene?
The InChIKey is XUMPYPYLBJWWNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20/c1-6-14-7-8-15-9-10(2)11(3)12(4)16(15)13(14)5/h7-9H,6H2,1-5H3.
What are the key properties of 7-ethyl-1,2,3,8-tetramethylnaphthalene?
7-ethyl-1,2,3,8-tetramethylnaphthalene has a molecular weight of 212.34 g/mol, XLogP of 4.64, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-1,2,3,8-tetramethylnaphthalene is sourced from PubChem (CID 162292672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).