7,11,15-trimethyl-3-methylidenehexadec-1-ene

C20H38 — CID 10446

IUPAC7,11,15-trimethyl-3-methylidenehexadec-1-ene
SMILESC=CC(=C)CCCC(C)CCCC(C)CCCC(C)C
InChIInChI=1S/C20H38/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3/h7,17,19-20H,1,4,8-16H2,2-3,5-6H3
InChIKeyNIDGCIPAMWNKOA-UHFFFAOYSA-N
MW278.52 g/mol
LogP7.17
Rot. Bonds13

About 7,11,15-trimethyl-3-methylidenehexadec-1-ene

7,11,15-trimethyl-3-methylidenehexadec-1-ene (PubChem CID 10446) has the molecular formula C20H38 and a molecular weight of 278.52 g/mol. Its IUPAC name is 7,11,15-trimethyl-3-methylidenehexadec-1-ene.

Molecular Properties

Compound Name7,11,15-trimethyl-3-methylidenehexadec-1-ene
PubChem CID10446
Molecular FormulaC20H38
Molecular Weight278.52 g/mol
Exact Mass278.30
IUPAC Name7,11,15-trimethyl-3-methylidenehexadec-1-ene
SMILESC=CC(=C)CCCC(C)CCCC(C)CCCC(C)C
InChIInChI=1S/C20H38/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3/h7,17,19-20H,1,4,8-16H2,2-3,5-6H3
InChIKeyNIDGCIPAMWNKOA-UHFFFAOYSA-N
XLogP7.17
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500278.52
LogP ≤ 57.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 7,11,15-trimethyl-3-methylidenehexadec-1-ene?
The IUPAC name of 7,11,15-trimethyl-3-methylidenehexadec-1-ene (CID 10446) is 7,11,15-trimethyl-3-methylidenehexadec-1-ene.
What is the SMILES notation for 7,11,15-trimethyl-3-methylidenehexadec-1-ene?
The canonical SMILES for 7,11,15-trimethyl-3-methylidenehexadec-1-ene is C=CC(=C)CCCC(C)CCCC(C)CCCC(C)C.
What is the InChIKey of 7,11,15-trimethyl-3-methylidenehexadec-1-ene?
The InChIKey is NIDGCIPAMWNKOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H38/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3/h7,17,19-20H,1,4,8-16H2,2-3,5-6H3.
What are the key properties of 7,11,15-trimethyl-3-methylidenehexadec-1-ene?
7,11,15-trimethyl-3-methylidenehexadec-1-ene has a molecular weight of 278.52 g/mol, XLogP of 7.17, 13 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7,11,15-trimethyl-3-methylidenehexadec-1-ene is sourced from PubChem (CID 10446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).