5-methyl-6-methylidenecyclohexa-1,3-diene

C8H10 — CID 71318228

IUPAC5-methyl-6-methylidenecyclohexa-1,3-diene
SMILESC=C1C=CC=CC1C
InChIInChI=1S/C8H10/c1-7-5-3-4-6-8(7)2/h3-6,8H,1H2,2H3
InChIKeyBTCILYXBYQMJNY-UHFFFAOYSA-N
MW106.17 g/mol
LogP2.30
Rot. Bonds

About 5-methyl-6-methylidenecyclohexa-1,3-diene

5-methyl-6-methylidenecyclohexa-1,3-diene (PubChem CID 71318228) has the molecular formula C8H10 and a molecular weight of 106.17 g/mol. Its IUPAC name is 5-methyl-6-methylidenecyclohexa-1,3-diene.

Molecular Properties

Compound Name5-methyl-6-methylidenecyclohexa-1,3-diene
PubChem CID71318228
Molecular FormulaC8H10
Molecular Weight106.17 g/mol
Exact Mass106.08
IUPAC Name5-methyl-6-methylidenecyclohexa-1,3-diene
SMILESC=C1C=CC=CC1C
InChIInChI=1S/C8H10/c1-7-5-3-4-6-8(7)2/h3-6,8H,1H2,2H3
InChIKeyBTCILYXBYQMJNY-UHFFFAOYSA-N
XLogP2.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500106.17
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-6-methylidenecyclohexa-1,3-diene?
The IUPAC name of 5-methyl-6-methylidenecyclohexa-1,3-diene (CID 71318228) is 5-methyl-6-methylidenecyclohexa-1,3-diene.
What is the SMILES notation for 5-methyl-6-methylidenecyclohexa-1,3-diene?
The canonical SMILES for 5-methyl-6-methylidenecyclohexa-1,3-diene is C=C1C=CC=CC1C.
What is the InChIKey of 5-methyl-6-methylidenecyclohexa-1,3-diene?
The InChIKey is BTCILYXBYQMJNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10/c1-7-5-3-4-6-8(7)2/h3-6,8H,1H2,2H3.
What are the key properties of 5-methyl-6-methylidenecyclohexa-1,3-diene?
5-methyl-6-methylidenecyclohexa-1,3-diene has a molecular weight of 106.17 g/mol, XLogP of 2.30, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-6-methylidenecyclohexa-1,3-diene is sourced from PubChem (CID 71318228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).