2,6,10-trimethyl-14-methylidenehexadecane

C20H40 — CID 123392528

IUPAC2,6,10-trimethyl-14-methylidenehexadecane
SMILESC=C(CC)CCCC(C)CCCC(C)CCCC(C)C
InChIInChI=1S/C20H40/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3/h17,19-20H,4,7-16H2,1-3,5-6H3
InChIKeyWPMGBXVOUYYUEN-UHFFFAOYSA-N
MW280.54 g/mol
LogP7.39
Rot. Bonds13

About 2,6,10-trimethyl-14-methylidenehexadecane

2,6,10-trimethyl-14-methylidenehexadecane (PubChem CID 123392528) has the molecular formula C20H40 and a molecular weight of 280.54 g/mol. Its IUPAC name is 2,6,10-trimethyl-14-methylidenehexadecane.

Molecular Properties

Compound Name2,6,10-trimethyl-14-methylidenehexadecane
PubChem CID123392528
Molecular FormulaC20H40
Molecular Weight280.54 g/mol
Exact Mass280.31
IUPAC Name2,6,10-trimethyl-14-methylidenehexadecane
SMILESC=C(CC)CCCC(C)CCCC(C)CCCC(C)C
InChIInChI=1S/C20H40/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3/h17,19-20H,4,7-16H2,1-3,5-6H3
InChIKeyWPMGBXVOUYYUEN-UHFFFAOYSA-N
XLogP7.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500280.54
LogP ≤ 57.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

alpha-Camphorene
CID 101750
2,4-Dimethyl-1-heptene
CID 123385
Neophytadiene
CID 10446
(14E,18E)-lycopadiene
CID 13889926
m-Camphorene
CID 5315649
1-Decene, dimer
CID 22833390
1-Heptene, 2,6-dimethyl-
CID 76492
(+-)-N,N-Dimethyl menthyl succinamide
CID 544714
1-Methyl-4-(1-methylethenyl)cyclohexane
CID 14299
3-Ethyl-2-methyl-1-heptene
CID 140588
p-Menth-1(7)-ene
CID 517973
1,8-Nonadiene, 2,7-dimethyl-5-(1-methylethenyl)-
CID 572166

Frequently Asked Questions

What is the IUPAC name of 2,6,10-trimethyl-14-methylidenehexadecane?
The IUPAC name of 2,6,10-trimethyl-14-methylidenehexadecane (CID 123392528) is 2,6,10-trimethyl-14-methylidenehexadecane.
What is the SMILES notation for 2,6,10-trimethyl-14-methylidenehexadecane?
The canonical SMILES for 2,6,10-trimethyl-14-methylidenehexadecane is C=C(CC)CCCC(C)CCCC(C)CCCC(C)C.
What is the InChIKey of 2,6,10-trimethyl-14-methylidenehexadecane?
The InChIKey is WPMGBXVOUYYUEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H40/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3/h17,19-20H,4,7-16H2,1-3,5-6H3.
What are the key properties of 2,6,10-trimethyl-14-methylidenehexadecane?
2,6,10-trimethyl-14-methylidenehexadecane has a molecular weight of 280.54 g/mol, XLogP of 7.39, 13 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6,10-trimethyl-14-methylidenehexadecane is sourced from PubChem (CID 123392528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).