2,4,6,8,10,12,14,16,18,20-decamethylhenicosane

C31H64 — CID 123384520

IUPAC2,4,6,8,10,12,14,16,18,20-decamethylhenicosane
SMILESCC(C)CC(C)CC(C)CC(C)CC(C)CC(C)CC(C)CC(C)CC(C)CC(C)C
InChIInChI=1S/C31H64/c1-22(2)13-24(5)15-26(7)17-28(9)19-30(11)21-31(12)20-29(10)18-27(8)16-25(6)14-23(3)4/h22-31H,13-21H2,1-12H3
InChIKeyBDWWTAWDKIRWCP-UHFFFAOYSA-N
MW436.85 g/mol
LogP10.90
Rot. Bonds18

About 2,4,6,8,10,12,14,16,18,20-decamethylhenicosane

2,4,6,8,10,12,14,16,18,20-decamethylhenicosane (PubChem CID 123384520) has the molecular formula C31H64 and a molecular weight of 436.85 g/mol. Its IUPAC name is 2,4,6,8,10,12,14,16,18,20-decamethylhenicosane.

Molecular Properties

Compound Name2,4,6,8,10,12,14,16,18,20-decamethylhenicosane
PubChem CID123384520
Molecular FormulaC31H64
Molecular Weight436.85 g/mol
Exact Mass436.50
IUPAC Name2,4,6,8,10,12,14,16,18,20-decamethylhenicosane
SMILESCC(C)CC(C)CC(C)CC(C)CC(C)CC(C)CC(C)CC(C)CC(C)CC(C)C
InChIInChI=1S/C31H64/c1-22(2)13-24(5)15-26(7)17-28(9)19-30(11)21-31(12)20-29(10)18-27(8)16-25(6)14-23(3)4/h22-31H,13-21H2,1-12H3
InChIKeyBDWWTAWDKIRWCP-UHFFFAOYSA-N
XLogP10.90
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds18
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500436.85
LogP ≤ 510.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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2,4,6,8-tetramethyldecane
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2,4,6,8,10,12,14-heptamethylheptadecane
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2,4,6,8,10-pentamethyltridecane
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3,5,7-trimethyloctan-1-amine
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Frequently Asked Questions

What is the IUPAC name of 2,4,6,8,10,12,14,16,18,20-decamethylhenicosane?
The IUPAC name of 2,4,6,8,10,12,14,16,18,20-decamethylhenicosane (CID 123384520) is 2,4,6,8,10,12,14,16,18,20-decamethylhenicosane.
What is the SMILES notation for 2,4,6,8,10,12,14,16,18,20-decamethylhenicosane?
The canonical SMILES for 2,4,6,8,10,12,14,16,18,20-decamethylhenicosane is CC(C)CC(C)CC(C)CC(C)CC(C)CC(C)CC(C)CC(C)CC(C)CC(C)C.
What is the InChIKey of 2,4,6,8,10,12,14,16,18,20-decamethylhenicosane?
The InChIKey is BDWWTAWDKIRWCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H64/c1-22(2)13-24(5)15-26(7)17-28(9)19-30(11)21-31(12)20-29(10)18-27(8)16-25(6)14-23(3)4/h22-31H,13-21H2,1-12H3.
What are the key properties of 2,4,6,8,10,12,14,16,18,20-decamethylhenicosane?
2,4,6,8,10,12,14,16,18,20-decamethylhenicosane has a molecular weight of 436.85 g/mol, XLogP of 10.90, 18 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6,8,10,12,14,16,18,20-decamethylhenicosane is sourced from PubChem (CID 123384520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).