[(Z)-(6-methylcyclohexa-2,4-dien-1-ylidene)methyl]diazene

C8H10N2 — CID 138642887

IUPAC[(Z)-(6-methylcyclohexa-2,4-dien-1-ylidene)methyl]diazene
SMILES[H]/N=N/C=C1/C=CC=CC1C
InChIInChI=1S/C8H10N2/c1-7-4-2-3-5-8(7)6-10-9/h2-7,9H,1H3/b8-6-,10-9+
InChIKeyVMKLQVKDHZNVGE-JWJWWGMXSA-N
MW134.18 g/mol
LogP2.66
Rot. Bonds1

About [(Z)-(6-methylcyclohexa-2,4-dien-1-ylidene)methyl]diazene

[(Z)-(6-methylcyclohexa-2,4-dien-1-ylidene)methyl]diazene (PubChem CID 138642887) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is [(Z)-(6-methylcyclohexa-2,4-dien-1-ylidene)methyl]diazene.

Molecular Properties

Compound Name[(Z)-(6-methylcyclohexa-2,4-dien-1-ylidene)methyl]diazene
PubChem CID138642887
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC Name[(Z)-(6-methylcyclohexa-2,4-dien-1-ylidene)methyl]diazene
SMILES[H]/N=N/C=C1/C=CC=CC1C
InChIInChI=1S/C8H10N2/c1-7-4-2-3-5-8(7)6-10-9/h2-7,9H,1H3/b8-6-,10-9+
InChIKeyVMKLQVKDHZNVGE-JWJWWGMXSA-N
XLogP2.66
TPSA36.21 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(Z)-(6-methylcyclohexa-2,4-dien-1-ylidene)methyl]diazene?
The IUPAC name of [(Z)-(6-methylcyclohexa-2,4-dien-1-ylidene)methyl]diazene (CID 138642887) is [(Z)-(6-methylcyclohexa-2,4-dien-1-ylidene)methyl]diazene.
What is the SMILES notation for [(Z)-(6-methylcyclohexa-2,4-dien-1-ylidene)methyl]diazene?
The canonical SMILES for [(Z)-(6-methylcyclohexa-2,4-dien-1-ylidene)methyl]diazene is [H]/N=N/C=C1/C=CC=CC1C.
What is the InChIKey of [(Z)-(6-methylcyclohexa-2,4-dien-1-ylidene)methyl]diazene?
The InChIKey is VMKLQVKDHZNVGE-JWJWWGMXSA-N. The full InChI is InChI=1S/C8H10N2/c1-7-4-2-3-5-8(7)6-10-9/h2-7,9H,1H3/b8-6-,10-9+.
What are the key properties of [(Z)-(6-methylcyclohexa-2,4-dien-1-ylidene)methyl]diazene?
[(Z)-(6-methylcyclohexa-2,4-dien-1-ylidene)methyl]diazene has a molecular weight of 134.18 g/mol, XLogP of 2.66, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-(6-methylcyclohexa-2,4-dien-1-ylidene)methyl]diazene is sourced from PubChem (CID 138642887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).