2,2-diethyl-4,8-dimethyl-7-propan-2-ylidenedec-3-en-1-ol

C19H36O — CID 123852562

IUPAC2,2-diethyl-4,8-dimethyl-7-propan-2-ylidenedec-3-en-1-ol
SMILESCCC(C)C(CCC(C)=CC(CC)(CC)CO)=C(C)C
InChIInChI=1S/C19H36O/c1-8-17(7)18(15(4)5)12-11-16(6)13-19(9-2,10-3)14-20/h13,17,20H,8-12,14H2,1-7H3
InChIKeyCFGUDACHRJEECU-UHFFFAOYSA-N
MW280.50 g/mol
LogP5.89
Rot. Bonds9

About 2,2-diethyl-4,8-dimethyl-7-propan-2-ylidenedec-3-en-1-ol

2,2-diethyl-4,8-dimethyl-7-propan-2-ylidenedec-3-en-1-ol (PubChem CID 123852562) has the molecular formula C19H36O and a molecular weight of 280.50 g/mol. Its IUPAC name is 2,2-diethyl-4,8-dimethyl-7-propan-2-ylidenedec-3-en-1-ol.

Molecular Properties

Compound Name2,2-diethyl-4,8-dimethyl-7-propan-2-ylidenedec-3-en-1-ol
PubChem CID123852562
Molecular FormulaC19H36O
Molecular Weight280.50 g/mol
Exact Mass280.28
IUPAC Name2,2-diethyl-4,8-dimethyl-7-propan-2-ylidenedec-3-en-1-ol
SMILESCCC(C)C(CCC(C)=CC(CC)(CC)CO)=C(C)C
InChIInChI=1S/C19H36O/c1-8-17(7)18(15(4)5)12-11-16(6)13-19(9-2,10-3)14-20/h13,17,20H,8-12,14H2,1-7H3
InChIKeyCFGUDACHRJEECU-UHFFFAOYSA-N
XLogP5.89
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500280.50
LogP ≤ 55.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 154351478
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CID 167046089
2,3-dimethylpent-1-ene;3,3-dimethylpent-1-ene
CID 158024808
2,2,4-trimethylhexan-1-ol
CID 14747424
6-butan-2-yl-4,4-diethyl-5-propan-2-yldec-5-ene
CID 141158605
(4E)-2,3,5,6-tetramethylocta-2,4-diene
CID 145376996
2-ethyl-2-methylpentane-1,4-diol
CID 57298661
4-(hydroxymethyl)-2,4-dimethylhexanoic acid
CID 20734605
2-ethyl-2-(3-methylbut-3-enyl)hex-3-en-1-ol
CID 140998277
(4E,6E,8S)-4,8-dimethyldeca-4,6-dienoic acid
CID 11367593
2-methyl-2-(pentan-3-ylamino)butan-1-ol
CID 78996542

Frequently Asked Questions

What is the IUPAC name of 2,2-diethyl-4,8-dimethyl-7-propan-2-ylidenedec-3-en-1-ol?
The IUPAC name of 2,2-diethyl-4,8-dimethyl-7-propan-2-ylidenedec-3-en-1-ol (CID 123852562) is 2,2-diethyl-4,8-dimethyl-7-propan-2-ylidenedec-3-en-1-ol.
What is the SMILES notation for 2,2-diethyl-4,8-dimethyl-7-propan-2-ylidenedec-3-en-1-ol?
The canonical SMILES for 2,2-diethyl-4,8-dimethyl-7-propan-2-ylidenedec-3-en-1-ol is CCC(C)C(CCC(C)=CC(CC)(CC)CO)=C(C)C.
What is the InChIKey of 2,2-diethyl-4,8-dimethyl-7-propan-2-ylidenedec-3-en-1-ol?
The InChIKey is CFGUDACHRJEECU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H36O/c1-8-17(7)18(15(4)5)12-11-16(6)13-19(9-2,10-3)14-20/h13,17,20H,8-12,14H2,1-7H3.
What are the key properties of 2,2-diethyl-4,8-dimethyl-7-propan-2-ylidenedec-3-en-1-ol?
2,2-diethyl-4,8-dimethyl-7-propan-2-ylidenedec-3-en-1-ol has a molecular weight of 280.50 g/mol, XLogP of 5.89, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethyl-4,8-dimethyl-7-propan-2-ylidenedec-3-en-1-ol is sourced from PubChem (CID 123852562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).