7-methylidene-1H-naphthalene

C11H9+ — CID 136803302

IUPAC7-methylidene-1H-naphthalene
SMILES[H]/[C+]=c1\ccc2c(c1)CC=CC=2
InChIInChI=1S/C11H9/c1-9-6-7-10-4-2-3-5-11(10)8-9/h1-4,6-8H,5H2/q+1
InChIKeyFQKWKFOAYZHDEV-UHFFFAOYSA-N
MW141.19 g/mol
LogP0.87
Rot. Bonds

About 7-methylidene-1H-naphthalene

7-methylidene-1H-naphthalene (PubChem CID 136803302) has the molecular formula C11H9+ and a molecular weight of 141.19 g/mol. Its IUPAC name is 7-methylidene-1H-naphthalene.

Molecular Properties

Compound Name7-methylidene-1H-naphthalene
PubChem CID136803302
Molecular FormulaC11H9+
Molecular Weight141.19 g/mol
Exact Mass141.07
IUPAC Name7-methylidene-1H-naphthalene
SMILES[H]/[C+]=c1\ccc2c(c1)CC=CC=2
InChIInChI=1S/C11H9/c1-9-6-7-10-4-2-3-5-11(10)8-9/h1-4,6-8H,5H2/q+1
InChIKeyFQKWKFOAYZHDEV-UHFFFAOYSA-N
XLogP0.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.19
LogP ≤ 50.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

10-methylidene-1H-anthracene
CID 136880566
tetra(cyclopenta-1,3-dien-1-yl)stannane
CID 67577909
bis(cyclohexa-1,4-diene);1,5-dihydroanthracene;1,5-dihydronaphthalene;1,7-dihydronaphthalene
CID 159591609
5-methyl-9H-benzo[7]annulene
CID 123648201
1-cyclopenta-1,3-dien-1-ylcyclopenta-1,3-diene;nickel(2+)
CID 21161619
3-propan-2-yl-8H-benzo[7]annulene
CID 145265248
1H-cyclopenta[b]triphenylene
CID 87358942
cyclopenta-1,3-dien-1-yl(trimethyl)azanium;platinum
CID 174617970
cyclopenta-1,3-dien-1-ylphosphinous acid
CID 161175959
5-methyl-9H-cyclohepta[c]pyridine
CID 145127682
cyclopenta-1,3-dien-1-yl-λ2-stannane
CID 173389158
lithium;1-cyclopenta-1,3-dien-1-ylcyclopenta-1,3-diene;hydride
CID 173293173

Frequently Asked Questions

What is the IUPAC name of 7-methylidene-1H-naphthalene?
The IUPAC name of 7-methylidene-1H-naphthalene (CID 136803302) is 7-methylidene-1H-naphthalene.
What is the SMILES notation for 7-methylidene-1H-naphthalene?
The canonical SMILES for 7-methylidene-1H-naphthalene is [H]/[C+]=c1\ccc2c(c1)CC=CC=2.
What is the InChIKey of 7-methylidene-1H-naphthalene?
The InChIKey is FQKWKFOAYZHDEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9/c1-9-6-7-10-4-2-3-5-11(10)8-9/h1-4,6-8H,5H2/q+1.
What are the key properties of 7-methylidene-1H-naphthalene?
7-methylidene-1H-naphthalene has a molecular weight of 141.19 g/mol, XLogP of 0.87, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methylidene-1H-naphthalene is sourced from PubChem (CID 136803302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).