3-ethoxy-2,6-di(propan-2-yl)naphthalene

C18H24O — CID 176586684

IUPAC3-ethoxy-2,6-di(propan-2-yl)naphthalene
SMILESCCOc1cc2cc(C(C)C)ccc2cc1C(C)C
InChIInChI=1S/C18H24O/c1-6-19-18-11-16-9-14(12(2)3)7-8-15(16)10-17(18)13(4)5/h7-13H,6H2,1-5H3
InChIKeyFNKSSCZVIBFQHJ-UHFFFAOYSA-N
MW256.39 g/mol
LogP5.49
Rot. Bonds4

About 3-ethoxy-2,6-di(propan-2-yl)naphthalene

3-ethoxy-2,6-di(propan-2-yl)naphthalene (PubChem CID 176586684) has the molecular formula C18H24O and a molecular weight of 256.39 g/mol. Its IUPAC name is 3-ethoxy-2,6-di(propan-2-yl)naphthalene.

Molecular Properties

Compound Name3-ethoxy-2,6-di(propan-2-yl)naphthalene
PubChem CID176586684
Molecular FormulaC18H24O
Molecular Weight256.39 g/mol
Exact Mass256.18
IUPAC Name3-ethoxy-2,6-di(propan-2-yl)naphthalene
SMILESCCOc1cc2cc(C(C)C)ccc2cc1C(C)C
InChIInChI=1S/C18H24O/c1-6-19-18-11-16-9-14(12(2)3)7-8-15(16)10-17(18)13(4)5/h7-13H,6H2,1-5H3
InChIKeyFNKSSCZVIBFQHJ-UHFFFAOYSA-N
XLogP5.49
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500256.39
LogP ≤ 55.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,9-di(propan-2-yl)pentacene
CID 153380534
2,6-di(propan-2-yl)naphthalene;ethane
CID 142320223
2-ethoxy-1-methoxy-4-propan-2-ylbenzene
CID 22087689
1,4-diethoxy-2-propan-2-ylbenzene
CID 129196403
2-propan-2-ylpentacene
CID 153380535
3,6-dimethoxy-2-propan-2-ylnaphthalene
CID 71390395
N,N-dimethyl-3-(7-propan-2-ylnaphthalen-2-yl)oxypropan-1-amine
CID 121353391
2-(2-phenoxyethoxy)-7-propan-2-ylnaphthalene
CID 90144659
ethane;2-propan-2-ylnaphthalene
CID 142226111
2-propan-2-yl-6-(6-propan-2-ylnaphthalen-2-yl)naphthalene
CID 59610790
2,4-diethoxy-1-propan-2-ylbenzene;2-(ethoxymethyl)-1-fluoro-4-propan-2-ylbenzene
CID 177172096
2-[2,4-di(propan-2-yl)phenoxy]ethanol
CID 166451717

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-2,6-di(propan-2-yl)naphthalene?
The IUPAC name of 3-ethoxy-2,6-di(propan-2-yl)naphthalene (CID 176586684) is 3-ethoxy-2,6-di(propan-2-yl)naphthalene.
What is the SMILES notation for 3-ethoxy-2,6-di(propan-2-yl)naphthalene?
The canonical SMILES for 3-ethoxy-2,6-di(propan-2-yl)naphthalene is CCOc1cc2cc(C(C)C)ccc2cc1C(C)C.
What is the InChIKey of 3-ethoxy-2,6-di(propan-2-yl)naphthalene?
The InChIKey is FNKSSCZVIBFQHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24O/c1-6-19-18-11-16-9-14(12(2)3)7-8-15(16)10-17(18)13(4)5/h7-13H,6H2,1-5H3.
What are the key properties of 3-ethoxy-2,6-di(propan-2-yl)naphthalene?
3-ethoxy-2,6-di(propan-2-yl)naphthalene has a molecular weight of 256.39 g/mol, XLogP of 5.49, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-2,6-di(propan-2-yl)naphthalene is sourced from PubChem (CID 176586684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).