7-ethyl-2,3,6,9-tetramethyl-4-propyldecane

C19H40 — CID 171102874

IUPAC7-ethyl-2,3,6,9-tetramethyl-4-propyldecane
SMILESCCCC(CC(C)C(CC)CC(C)C)C(C)C(C)C
InChIInChI=1S/C19H40/c1-9-11-19(17(8)15(5)6)13-16(7)18(10-2)12-14(3)4/h14-19H,9-13H2,1-8H3
InChIKeyJVNJXXNJYUCZEG-UHFFFAOYSA-N
MW268.53 g/mol
LogP6.79
Rot. Bonds10

About 7-ethyl-2,3,6,9-tetramethyl-4-propyldecane

7-ethyl-2,3,6,9-tetramethyl-4-propyldecane (PubChem CID 171102874) has the molecular formula C19H40 and a molecular weight of 268.53 g/mol. Its IUPAC name is 7-ethyl-2,3,6,9-tetramethyl-4-propyldecane.

Molecular Properties

Compound Name7-ethyl-2,3,6,9-tetramethyl-4-propyldecane
PubChem CID171102874
Molecular FormulaC19H40
Molecular Weight268.53 g/mol
Exact Mass268.31
IUPAC Name7-ethyl-2,3,6,9-tetramethyl-4-propyldecane
SMILESCCCC(CC(C)C(CC)CC(C)C)C(C)C(C)C
InChIInChI=1S/C19H40/c1-9-11-19(17(8)15(5)6)13-16(7)18(10-2)12-14(3)4/h14-19H,9-13H2,1-8H3
InChIKeyJVNJXXNJYUCZEG-UHFFFAOYSA-N
XLogP6.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.53
LogP ≤ 56.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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2,3,6,7-tetramethyl-5-propylnonane
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2-methyl-4-propan-2-ylheptane
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5-ethyl-2,3,4,7-tetramethyloctane
CID 57492474
2,5-dimethyl-4-propyloctane
CID 57491236
4,5-diethyloctane
CID 519254
6-ethyl-2,5-dimethylnonane
CID 54499682
bis(3-ethyl-2,5-dimethylhexane);2,3,5-trimethylhexane
CID 158124922
4-ethyl-2,3,6,7,10-pentamethyl-11-propylheptadecane
CID 142573468
(3R)-3-ethyl-2-methylhexane
CID 59954424

Frequently Asked Questions

What is the IUPAC name of 7-ethyl-2,3,6,9-tetramethyl-4-propyldecane?
The IUPAC name of 7-ethyl-2,3,6,9-tetramethyl-4-propyldecane (CID 171102874) is 7-ethyl-2,3,6,9-tetramethyl-4-propyldecane.
What is the SMILES notation for 7-ethyl-2,3,6,9-tetramethyl-4-propyldecane?
The canonical SMILES for 7-ethyl-2,3,6,9-tetramethyl-4-propyldecane is CCCC(CC(C)C(CC)CC(C)C)C(C)C(C)C.
What is the InChIKey of 7-ethyl-2,3,6,9-tetramethyl-4-propyldecane?
The InChIKey is JVNJXXNJYUCZEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40/c1-9-11-19(17(8)15(5)6)13-16(7)18(10-2)12-14(3)4/h14-19H,9-13H2,1-8H3.
What are the key properties of 7-ethyl-2,3,6,9-tetramethyl-4-propyldecane?
7-ethyl-2,3,6,9-tetramethyl-4-propyldecane has a molecular weight of 268.53 g/mol, XLogP of 6.79, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-2,3,6,9-tetramethyl-4-propyldecane is sourced from PubChem (CID 171102874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).