(8,9-dimethyl-6-methylidenedeca-1,8-dienyl)benzene

C19H26 — CID 134863216

IUPAC(8,9-dimethyl-6-methylidenedeca-1,8-dienyl)benzene
SMILESC=C(CCCC=Cc1ccccc1)CC(C)=C(C)C
InChIInChI=1S/C19H26/c1-16(2)18(4)15-17(3)11-7-5-8-12-19-13-9-6-10-14-19/h6,8-10,12-14H,3,5,7,11,15H2,1-2,4H3
InChIKeyFBISKDMBBDKEPP-UHFFFAOYSA-N
MW254.42 g/mol
LogP6.17
Rot. Bonds7

About (8,9-dimethyl-6-methylidenedeca-1,8-dienyl)benzene

(8,9-dimethyl-6-methylidenedeca-1,8-dienyl)benzene (PubChem CID 134863216) has the molecular formula C19H26 and a molecular weight of 254.42 g/mol. Its IUPAC name is (8,9-dimethyl-6-methylidenedeca-1,8-dienyl)benzene.

Molecular Properties

Compound Name(8,9-dimethyl-6-methylidenedeca-1,8-dienyl)benzene
PubChem CID134863216
Molecular FormulaC19H26
Molecular Weight254.42 g/mol
Exact Mass254.20
IUPAC Name(8,9-dimethyl-6-methylidenedeca-1,8-dienyl)benzene
SMILESC=C(CCCC=Cc1ccccc1)CC(C)=C(C)C
InChIInChI=1S/C19H26/c1-16(2)18(4)15-17(3)11-7-5-8-12-19-13-9-6-10-14-19/h6,8-10,12-14H,3,5,7,11,15H2,1-2,4H3
InChIKeyFBISKDMBBDKEPP-UHFFFAOYSA-N
XLogP6.17
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms19
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500254.42
LogP ≤ 56.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (8,9-dimethyl-6-methylidenedeca-1,8-dienyl)benzene?
The IUPAC name of (8,9-dimethyl-6-methylidenedeca-1,8-dienyl)benzene (CID 134863216) is (8,9-dimethyl-6-methylidenedeca-1,8-dienyl)benzene.
What is the SMILES notation for (8,9-dimethyl-6-methylidenedeca-1,8-dienyl)benzene?
The canonical SMILES for (8,9-dimethyl-6-methylidenedeca-1,8-dienyl)benzene is C=C(CCCC=Cc1ccccc1)CC(C)=C(C)C.
What is the InChIKey of (8,9-dimethyl-6-methylidenedeca-1,8-dienyl)benzene?
The InChIKey is FBISKDMBBDKEPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26/c1-16(2)18(4)15-17(3)11-7-5-8-12-19-13-9-6-10-14-19/h6,8-10,12-14H,3,5,7,11,15H2,1-2,4H3.
What are the key properties of (8,9-dimethyl-6-methylidenedeca-1,8-dienyl)benzene?
(8,9-dimethyl-6-methylidenedeca-1,8-dienyl)benzene has a molecular weight of 254.42 g/mol, XLogP of 6.17, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (8,9-dimethyl-6-methylidenedeca-1,8-dienyl)benzene is sourced from PubChem (CID 134863216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).