8-ethenyl-1,2-dimethylnaphthalene

C14H14 — CID 123674776

IUPAC8-ethenyl-1,2-dimethylnaphthalene
SMILESC=Cc1cccc2ccc(C)c(C)c12
InChIInChI=1S/C14H14/c1-4-12-6-5-7-13-9-8-10(2)11(3)14(12)13/h4-9H,1H2,2-3H3
InChIKeyVMNBGKRDPJLRTR-UHFFFAOYSA-N
MW182.27 g/mol
LogP4.10
Rot. Bonds1

About 8-ethenyl-1,2-dimethylnaphthalene

8-ethenyl-1,2-dimethylnaphthalene (PubChem CID 123674776) has the molecular formula C14H14 and a molecular weight of 182.27 g/mol. Its IUPAC name is 8-ethenyl-1,2-dimethylnaphthalene.

Molecular Properties

Compound Name8-ethenyl-1,2-dimethylnaphthalene
PubChem CID123674776
Molecular FormulaC14H14
Molecular Weight182.27 g/mol
Exact Mass182.11
IUPAC Name8-ethenyl-1,2-dimethylnaphthalene
SMILESC=Cc1cccc2ccc(C)c(C)c12
InChIInChI=1S/C14H14/c1-4-12-6-5-7-13-9-8-10(2)11(3)14(12)13/h4-9H,1H2,2-3H3
InChIKeyVMNBGKRDPJLRTR-UHFFFAOYSA-N
XLogP4.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 8-ethenyl-1,2-dimethylnaphthalene?
The IUPAC name of 8-ethenyl-1,2-dimethylnaphthalene (CID 123674776) is 8-ethenyl-1,2-dimethylnaphthalene.
What is the SMILES notation for 8-ethenyl-1,2-dimethylnaphthalene?
The canonical SMILES for 8-ethenyl-1,2-dimethylnaphthalene is C=Cc1cccc2ccc(C)c(C)c12.
What is the InChIKey of 8-ethenyl-1,2-dimethylnaphthalene?
The InChIKey is VMNBGKRDPJLRTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14/c1-4-12-6-5-7-13-9-8-10(2)11(3)14(12)13/h4-9H,1H2,2-3H3.
What are the key properties of 8-ethenyl-1,2-dimethylnaphthalene?
8-ethenyl-1,2-dimethylnaphthalene has a molecular weight of 182.27 g/mol, XLogP of 4.10, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethenyl-1,2-dimethylnaphthalene is sourced from PubChem (CID 123674776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).