3-methylidene-1,2-dihydroindene

C10H9+ — CID 136697279

IUPAC3-methylidene-1,2-dihydroindene
SMILES[H]/[C+]=C1\CCc2ccccc21
InChIInChI=1S/C10H9/c1-8-6-7-9-4-2-3-5-10(8)9/h1-5H,6-7H2/q+1
InChIKeyRMYPJYMOQXZLAW-UHFFFAOYSA-N
MW129.18 g/mol
LogP2.45
Rot. Bonds

About 3-methylidene-1,2-dihydroindene

3-methylidene-1,2-dihydroindene (PubChem CID 136697279) has the molecular formula C10H9+ and a molecular weight of 129.18 g/mol. Its IUPAC name is 3-methylidene-1,2-dihydroindene.

Molecular Properties

Compound Name3-methylidene-1,2-dihydroindene
PubChem CID136697279
Molecular FormulaC10H9+
Molecular Weight129.18 g/mol
Exact Mass129.07
IUPAC Name3-methylidene-1,2-dihydroindene
SMILES[H]/[C+]=C1\CCc2ccccc21
InChIInChI=1S/C10H9/c1-8-6-7-9-4-2-3-5-10(8)9/h1-5H,6-7H2/q+1
InChIKeyRMYPJYMOQXZLAW-UHFFFAOYSA-N
XLogP2.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.18
LogP ≤ 52.45
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

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CID 159340402
2-propan-2-ylidenetricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene
CID 59340364
2,3-dihydroindene-1-thione;ethane
CID 142140670
2,3-dihydroinden-1-ylidenemethanediol
CID 14337503
(Z)-2,3-dihydroinden-1-ylidenehydrazine
CID 5382905
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CID 134854372
19,26-diazapentacyclo[16.8.0.04,9.010,15.020,25]hexacosa-1(26),4,6,8,10,12,14,18,20,22,24-undecaene
CID 165351241

Frequently Asked Questions

What is the IUPAC name of 3-methylidene-1,2-dihydroindene?
The IUPAC name of 3-methylidene-1,2-dihydroindene (CID 136697279) is 3-methylidene-1,2-dihydroindene.
What is the SMILES notation for 3-methylidene-1,2-dihydroindene?
The canonical SMILES for 3-methylidene-1,2-dihydroindene is [H]/[C+]=C1\CCc2ccccc21.
What is the InChIKey of 3-methylidene-1,2-dihydroindene?
The InChIKey is RMYPJYMOQXZLAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9/c1-8-6-7-9-4-2-3-5-10(8)9/h1-5H,6-7H2/q+1.
What are the key properties of 3-methylidene-1,2-dihydroindene?
3-methylidene-1,2-dihydroindene has a molecular weight of 129.18 g/mol, XLogP of 2.45, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylidene-1,2-dihydroindene is sourced from PubChem (CID 136697279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).