6-methylidenecyclohexa-2,4-diene-1-selone

C7H6Se — CID 14249672

IUPAC6-methylidenecyclohexa-2,4-diene-1-selone
SMILESC=C1C=CC=CC1=[Se]
InChIInChI=1S/C7H6Se/c1-6-4-2-3-5-7(6)8/h2-5H,1H2
InChIKeyUXOODAQTDOJJDL-UHFFFAOYSA-N
MW169.08 g/mol
LogP1.01
Rot. Bonds

About 6-methylidenecyclohexa-2,4-diene-1-selone

6-methylidenecyclohexa-2,4-diene-1-selone (PubChem CID 14249672) has the molecular formula C7H6Se and a molecular weight of 169.08 g/mol. Its IUPAC name is 6-methylidenecyclohexa-2,4-diene-1-selone.

Molecular Properties

Compound Name6-methylidenecyclohexa-2,4-diene-1-selone
PubChem CID14249672
Molecular FormulaC7H6Se
Molecular Weight169.08 g/mol
Exact Mass169.96
IUPAC Name6-methylidenecyclohexa-2,4-diene-1-selone
SMILESC=C1C=CC=CC1=[Se]
InChIInChI=1S/C7H6Se/c1-6-4-2-3-5-7(6)8/h2-5H,1H2
InChIKeyUXOODAQTDOJJDL-UHFFFAOYSA-N
XLogP1.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.08
LogP ≤ 51.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 6-methylidenecyclohexa-2,4-diene-1-selone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-hydroxy-6-methylidenecyclohexa-2,4-dien-1-imine oxide
CID 177396699
methane;6-methylidenecyclohexa-2,4-dien-1-one;2-methylpropane
CID 157497539
4-methylidene-1H-azulene
CID 144559189
8,9-dimethylidenebicyclo[4.4.1]undeca-1(10),2,4,6-tetraene
CID 15528895
1-(3-cycloprop-2-en-1-ylidenecyclopropen-1-yl)-5-methylidenecyclopenta-1,3-diene
CID 101113011
CID 101068244
CID 101068244
(5Z,7Z)-4-methylidene-3-(2-methylpropyl)thiocine
CID 174022072
1-iodyl-5-methylidenecyclopenta-1,3-diene
CID 140968042
(1E,3Z,5E,7Z,9Z)-4-methyl-11-methylidenecycloundeca-1,3,5,7,9-pentaen-1-amine
CID 163497639
5-methylidenecyclopenta-1,2,3-triene
CID 54170616
(4Z,7Z,10Z,13Z)-3,6,9,12,15-pentamethylidenecyclopentadeca-1,4,7,10,13-pentaene
CID 90931509
[6-di(propan-2-yl)phosphaniumylidenecyclohexa-2,4-dien-1-ylidene]-di(propan-2-yl)phosphanium
CID 175011532

Frequently Asked Questions

What is the IUPAC name of 6-methylidenecyclohexa-2,4-diene-1-selone?
The IUPAC name of 6-methylidenecyclohexa-2,4-diene-1-selone (CID 14249672) is 6-methylidenecyclohexa-2,4-diene-1-selone.
What is the SMILES notation for 6-methylidenecyclohexa-2,4-diene-1-selone?
The canonical SMILES for 6-methylidenecyclohexa-2,4-diene-1-selone is C=C1C=CC=CC1=[Se].
What is the InChIKey of 6-methylidenecyclohexa-2,4-diene-1-selone?
The InChIKey is UXOODAQTDOJJDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6Se/c1-6-4-2-3-5-7(6)8/h2-5H,1H2.
What are the key properties of 6-methylidenecyclohexa-2,4-diene-1-selone?
6-methylidenecyclohexa-2,4-diene-1-selone has a molecular weight of 169.08 g/mol, XLogP of 1.01, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylidenecyclohexa-2,4-diene-1-selone is sourced from PubChem (CID 14249672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).