1,2-bis(ethenyl)-6-methylnaphthalene;ethane;propane

C20H28 — CID 145447193

IUPAC1,2-bis(ethenyl)-6-methylnaphthalene;ethane;propane
SMILESC=Cc1ccc2cc(C)ccc2c1C=C.CC.CCC
InChIInChI=1S/C15H14.C3H8.C2H6/c1-4-12-7-8-13-10-11(3)6-9-15(13)14(12)5-2;1-3-2;1-2/h4-10H,1-2H2,3H3;3H2,1-2H3;1-2H3
InChIKeyYXWVPUCHEYAIIJ-UHFFFAOYSA-N
MW268.44 g/mol
LogP6.88
Rot. Bonds2

About 1,2-bis(ethenyl)-6-methylnaphthalene;ethane;propane

1,2-bis(ethenyl)-6-methylnaphthalene;ethane;propane (PubChem CID 145447193) has the molecular formula C20H28 and a molecular weight of 268.44 g/mol. Its IUPAC name is 1,2-bis(ethenyl)-6-methylnaphthalene;ethane;propane.

Molecular Properties

Compound Name1,2-bis(ethenyl)-6-methylnaphthalene;ethane;propane
PubChem CID145447193
Molecular FormulaC20H28
Molecular Weight268.44 g/mol
Exact Mass268.22
IUPAC Name1,2-bis(ethenyl)-6-methylnaphthalene;ethane;propane
SMILESC=Cc1ccc2cc(C)ccc2c1C=C.CC.CCC
InChIInChI=1S/C15H14.C3H8.C2H6/c1-4-12-7-8-13-10-11(3)6-9-15(13)14(12)5-2;1-3-2;1-2/h4-10H,1-2H2,3H3;3H2,1-2H3;1-2H3
InChIKeyYXWVPUCHEYAIIJ-UHFFFAOYSA-N
XLogP6.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.44
LogP ≤ 56.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-ethenyl-1,7-dimethylnaphthalene
CID 142881924
2,7-dimethylphenanthrene;ethane
CID 91503011
1,2-bis(ethenyl)-4-methylbenzene;ethane;prop-1-ene
CID 143109354
ethane;1-ethenyl-2-ethyl-7-methylnaphthalene
CID 142614708
1,2-bis(ethenyl)-4-methylbenzene;ethane;methane;prop-1-ene
CID 143109411
2,6-dimethylnaphthalene;propane
CID 142191183
1-ethenyl-2-ethyl-4-methylbenzene
CID 18626822
1,3-bis(ethenyl)-7-methylnaphthalene
CID 59335501
1,2-bis(ethenyl)-4-methylbenzene;methoxymethane
CID 142804443
2-(4-ethenyl-3-propylphenyl)-6-methylnaphthalene
CID 177009018
ethane;2-ethenylnaphthalene-1-carbaldehyde
CID 91162051
2,9-dimethylnaphtho[1,2-b]phenanthrene;3,10-dimethylnaphtho[1,2-b]phenanthrene
CID 164992833

Frequently Asked Questions

What is the IUPAC name of 1,2-bis(ethenyl)-6-methylnaphthalene;ethane;propane?
The IUPAC name of 1,2-bis(ethenyl)-6-methylnaphthalene;ethane;propane (CID 145447193) is 1,2-bis(ethenyl)-6-methylnaphthalene;ethane;propane.
What is the SMILES notation for 1,2-bis(ethenyl)-6-methylnaphthalene;ethane;propane?
The canonical SMILES for 1,2-bis(ethenyl)-6-methylnaphthalene;ethane;propane is C=Cc1ccc2cc(C)ccc2c1C=C.CC.CCC.
What is the InChIKey of 1,2-bis(ethenyl)-6-methylnaphthalene;ethane;propane?
The InChIKey is YXWVPUCHEYAIIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14.C3H8.C2H6/c1-4-12-7-8-13-10-11(3)6-9-15(13)14(12)5-2;1-3-2;1-2/h4-10H,1-2H2,3H3;3H2,1-2H3;1-2H3.
What are the key properties of 1,2-bis(ethenyl)-6-methylnaphthalene;ethane;propane?
1,2-bis(ethenyl)-6-methylnaphthalene;ethane;propane has a molecular weight of 268.44 g/mol, XLogP of 6.88, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(ethenyl)-6-methylnaphthalene;ethane;propane is sourced from PubChem (CID 145447193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).