3,8-dimethyl-1,2-dihydronaphthalene;ethane

C14H20 — CID 144557386

IUPAC3,8-dimethyl-1,2-dihydronaphthalene;ethane
SMILESCC.CC1=Cc2cccc(C)c2CC1
InChIInChI=1S/C12H14.C2H6/c1-9-6-7-12-10(2)4-3-5-11(12)8-9;1-2/h3-5,8H,6-7H2,1-2H3;1-2H3
InChIKeyCGIMEIJREIBAKC-UHFFFAOYSA-N
MW188.31 g/mol
LogP4.37
Rot. Bonds

About 3,8-dimethyl-1,2-dihydronaphthalene;ethane

3,8-dimethyl-1,2-dihydronaphthalene;ethane (PubChem CID 144557386) has the molecular formula C14H20 and a molecular weight of 188.31 g/mol. Its IUPAC name is 3,8-dimethyl-1,2-dihydronaphthalene;ethane.

Molecular Properties

Compound Name3,8-dimethyl-1,2-dihydronaphthalene;ethane
PubChem CID144557386
Molecular FormulaC14H20
Molecular Weight188.31 g/mol
Exact Mass188.16
IUPAC Name3,8-dimethyl-1,2-dihydronaphthalene;ethane
SMILESCC.CC1=Cc2cccc(C)c2CC1
InChIInChI=1S/C12H14.C2H6/c1-9-6-7-12-10(2)4-3-5-11(12)8-9;1-2/h3-5,8H,6-7H2,1-2H3;1-2H3
InChIKeyCGIMEIJREIBAKC-UHFFFAOYSA-N
XLogP4.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

5-methyl-3,4-dihydronaphthalene-2-carboxylic acid
CID 83829067
2-(5-methyl-3,4-dihydronaphthalen-2-yl)propanoic acid
CID 105469803
1,8-dimethyl-9,10-dihydrophenanthrene
CID 142741487
ethane;5-methyl-6,7-dihydro-1H-indole
CID 143140793
N-methyl-1-(7-methyl-1H-inden-2-yl)methanamine
CID 105435597
dichlorozirconium;7-methyl-2-propan-2-yl-1H-indene
CID 172740435
2-(isocyanomethyl)-7-methyl-1H-indene
CID 58001403
ethane;2-methyl-1H-indene
CID 54388135
3-(bromomethyl)-8-methyl-2-(2-methylphenyl)-1H-isoquinoline
CID 154217243
2-(2-methyl-3H-inden-4-yl)naphthalene
CID 158464529
2,7-dimethyl-1,2,5,6-tetrahydrophenanthrene
CID 143534934
3,7-dimethyl-1,2-dihydronaphthalene;ethane;methane
CID 144671945

Frequently Asked Questions

What is the IUPAC name of 3,8-dimethyl-1,2-dihydronaphthalene;ethane?
The IUPAC name of 3,8-dimethyl-1,2-dihydronaphthalene;ethane (CID 144557386) is 3,8-dimethyl-1,2-dihydronaphthalene;ethane.
What is the SMILES notation for 3,8-dimethyl-1,2-dihydronaphthalene;ethane?
The canonical SMILES for 3,8-dimethyl-1,2-dihydronaphthalene;ethane is CC.CC1=Cc2cccc(C)c2CC1.
What is the InChIKey of 3,8-dimethyl-1,2-dihydronaphthalene;ethane?
The InChIKey is CGIMEIJREIBAKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14.C2H6/c1-9-6-7-12-10(2)4-3-5-11(12)8-9;1-2/h3-5,8H,6-7H2,1-2H3;1-2H3.
What are the key properties of 3,8-dimethyl-1,2-dihydronaphthalene;ethane?
3,8-dimethyl-1,2-dihydronaphthalene;ethane has a molecular weight of 188.31 g/mol, XLogP of 4.37, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,8-dimethyl-1,2-dihydronaphthalene;ethane is sourced from PubChem (CID 144557386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).