3,4,5,9-tetramethyl-7-propyldodecane

C19H40 — CID 91586333

IUPAC3,4,5,9-tetramethyl-7-propyldodecane
SMILESCCCC(C)CC(CCC)CC(C)C(C)C(C)CC
InChIInChI=1S/C19H40/c1-8-11-15(4)13-19(12-9-2)14-17(6)18(7)16(5)10-3/h15-19H,8-14H2,1-7H3
InChIKeyUABOVSLEYAWOQM-UHFFFAOYSA-N
MW268.53 g/mol
LogP6.94
Rot. Bonds11

About 3,4,5,9-tetramethyl-7-propyldodecane

3,4,5,9-tetramethyl-7-propyldodecane (PubChem CID 91586333) has the molecular formula C19H40 and a molecular weight of 268.53 g/mol. Its IUPAC name is 3,4,5,9-tetramethyl-7-propyldodecane.

Molecular Properties

Compound Name3,4,5,9-tetramethyl-7-propyldodecane
PubChem CID91586333
Molecular FormulaC19H40
Molecular Weight268.53 g/mol
Exact Mass268.31
IUPAC Name3,4,5,9-tetramethyl-7-propyldodecane
SMILESCCCC(C)CC(CCC)CC(C)C(C)C(C)CC
InChIInChI=1S/C19H40/c1-8-11-15(4)13-19(12-9-2)14-17(6)18(7)16(5)10-3/h15-19H,8-14H2,1-7H3
InChIKeyUABOVSLEYAWOQM-UHFFFAOYSA-N
XLogP6.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.53
LogP ≤ 56.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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3,6-dimethylnonan-4-ol
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3-(bromomethyl)-5-methyloctane
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6-ethyl-3,4,9-trimethyldodecane
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7-ethyl-3,5,9-trimethyldodecane
CID 123315944
6-ethyl-4-methyldecane
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3,5,7,9,11,13,15-heptamethyloctadecane
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3,4,6,7-tetramethyl-5-propylnonane
CID 91018101
3,4,5,6,8-pentamethyldecane
CID 123810037
4,5,7-trimethyldecane
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Frequently Asked Questions

What is the IUPAC name of 3,4,5,9-tetramethyl-7-propyldodecane?
The IUPAC name of 3,4,5,9-tetramethyl-7-propyldodecane (CID 91586333) is 3,4,5,9-tetramethyl-7-propyldodecane.
What is the SMILES notation for 3,4,5,9-tetramethyl-7-propyldodecane?
The canonical SMILES for 3,4,5,9-tetramethyl-7-propyldodecane is CCCC(C)CC(CCC)CC(C)C(C)C(C)CC.
What is the InChIKey of 3,4,5,9-tetramethyl-7-propyldodecane?
The InChIKey is UABOVSLEYAWOQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40/c1-8-11-15(4)13-19(12-9-2)14-17(6)18(7)16(5)10-3/h15-19H,8-14H2,1-7H3.
What are the key properties of 3,4,5,9-tetramethyl-7-propyldodecane?
3,4,5,9-tetramethyl-7-propyldodecane has a molecular weight of 268.53 g/mol, XLogP of 6.94, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5,9-tetramethyl-7-propyldodecane is sourced from PubChem (CID 91586333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).