3,3,6,6-tetraethyltricyclo[3.1.0.02,4]hexane

C14H24 — CID 572173

IUPAC3,3,6,6-tetraethyltricyclo[3.1.0.02,4]hexane
SMILESCCC1(CC)C2C1C1C2C1(CC)CC
InChIInChI=1S/C14H24/c1-5-13(6-2)9-10(13)12-11(9)14(12,7-3)8-4/h9-12H,5-8H2,1-4H3
InChIKeyIUIFSUPCQCUASG-UHFFFAOYSA-N
MW192.35 g/mol
LogP4.10
Rot. Bonds4

About 3,3,6,6-tetraethyltricyclo[3.1.0.02,4]hexane

3,3,6,6-tetraethyltricyclo[3.1.0.02,4]hexane (PubChem CID 572173) has the molecular formula C14H24 and a molecular weight of 192.35 g/mol. Its IUPAC name is 3,3,6,6-tetraethyltricyclo[3.1.0.02,4]hexane.

Molecular Properties

Compound Name3,3,6,6-tetraethyltricyclo[3.1.0.02,4]hexane
PubChem CID572173
Molecular FormulaC14H24
Molecular Weight192.35 g/mol
Exact Mass192.19
IUPAC Name3,3,6,6-tetraethyltricyclo[3.1.0.02,4]hexane
SMILESCCC1(CC)C2C1C1C2C1(CC)CC
InChIInChI=1S/C14H24/c1-5-13(6-2)9-10(13)12-11(9)14(12,7-3)8-4/h9-12H,5-8H2,1-4H3
InChIKeyIUIFSUPCQCUASG-UHFFFAOYSA-N
XLogP4.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.35
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 3,3,6,6-tetraethyltricyclo[3.1.0.02,4]hexane?
The IUPAC name of 3,3,6,6-tetraethyltricyclo[3.1.0.02,4]hexane (CID 572173) is 3,3,6,6-tetraethyltricyclo[3.1.0.02,4]hexane.
What is the SMILES notation for 3,3,6,6-tetraethyltricyclo[3.1.0.02,4]hexane?
The canonical SMILES for 3,3,6,6-tetraethyltricyclo[3.1.0.02,4]hexane is CCC1(CC)C2C1C1C2C1(CC)CC.
What is the InChIKey of 3,3,6,6-tetraethyltricyclo[3.1.0.02,4]hexane?
The InChIKey is IUIFSUPCQCUASG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24/c1-5-13(6-2)9-10(13)12-11(9)14(12,7-3)8-4/h9-12H,5-8H2,1-4H3.
What are the key properties of 3,3,6,6-tetraethyltricyclo[3.1.0.02,4]hexane?
3,3,6,6-tetraethyltricyclo[3.1.0.02,4]hexane has a molecular weight of 192.35 g/mol, XLogP of 4.10, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,6,6-tetraethyltricyclo[3.1.0.02,4]hexane is sourced from PubChem (CID 572173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).