10,14-dimethyltetratriacontane

C36H74 — CID 86017565

IUPAC10,14-dimethyltetratriacontane
SMILESCCCCCCCCCCCCCCCCCCCCC(C)CCCC(C)CCCCCCCCC
InChIInChI=1S/C36H74/c1-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-25-27-29-32-36(4)34-30-33-35(3)31-28-26-24-12-10-8-6-2/h35-36H,5-34H2,1-4H3
InChIKeyLJFPKOJIYPWYJD-UHFFFAOYSA-N
MW506.99 g/mol
LogP14.00
Rot. Bonds31

About 10,14-dimethyltetratriacontane

10,14-dimethyltetratriacontane (PubChem CID 86017565) has the molecular formula C36H74 and a molecular weight of 506.99 g/mol. Its IUPAC name is 10,14-dimethyltetratriacontane.

Molecular Properties

Compound Name10,14-dimethyltetratriacontane
PubChem CID86017565
Molecular FormulaC36H74
Molecular Weight506.99 g/mol
Exact Mass506.58
IUPAC Name10,14-dimethyltetratriacontane
SMILESCCCCCCCCCCCCCCCCCCCCC(C)CCCC(C)CCCCCCCCC
InChIInChI=1S/C36H74/c1-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-25-27-29-32-36(4)34-30-33-35(3)31-28-26-24-12-10-8-6-2/h35-36H,5-34H2,1-4H3
InChIKeyLJFPKOJIYPWYJD-UHFFFAOYSA-N
XLogP14.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds31
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500506.99
LogP ≤ 514.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

7,11-dimethylpentatriacontane
CID 6430674
15,19-dimethylpentatriacontane
CID 521781
8,12,20-trimethyltetracontane
CID 6430679
(15R,19S)-15,19-dimethylheptatriacontane
CID 162889716
11,15-dimethylheptacosane
CID 6430046
10,14,18-trimethyldotriacontane
CID 86017574
11,15-dimethyltritriacontane
CID 521778
6,10-dimethyloctadecane
CID 86144179
6,10,24,28-tetramethyloctatriacontane
CID 6430659
7,11,21-trimethylhentriacontane
CID 6430672
11,15-dimethyloctacosane
CID 71367376
9,13-dimethylnonacosane
CID 6430077

Frequently Asked Questions

What is the IUPAC name of 10,14-dimethyltetratriacontane?
The IUPAC name of 10,14-dimethyltetratriacontane (CID 86017565) is 10,14-dimethyltetratriacontane.
What is the SMILES notation for 10,14-dimethyltetratriacontane?
The canonical SMILES for 10,14-dimethyltetratriacontane is CCCCCCCCCCCCCCCCCCCCC(C)CCCC(C)CCCCCCCCC.
What is the InChIKey of 10,14-dimethyltetratriacontane?
The InChIKey is LJFPKOJIYPWYJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H74/c1-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-25-27-29-32-36(4)34-30-33-35(3)31-28-26-24-12-10-8-6-2/h35-36H,5-34H2,1-4H3.
What are the key properties of 10,14-dimethyltetratriacontane?
10,14-dimethyltetratriacontane has a molecular weight of 506.99 g/mol, XLogP of 14.00, 31 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 10,14-dimethyltetratriacontane is sourced from PubChem (CID 86017565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).