2-methyl-1,10-bis[(2-methylpropan-2-yl)oxy]decane

C19H40O2 — CID 19888732

IUPAC2-methyl-1,10-bis[(2-methylpropan-2-yl)oxy]decane
SMILESCC(CCCCCCCCOC(C)(C)C)COC(C)(C)C
InChIInChI=1S/C19H40O2/c1-17(16-21-19(5,6)7)14-12-10-8-9-11-13-15-20-18(2,3)4/h17H,8-16H2,1-7H3
InChIKeyPDKAKJUZHFIALN-UHFFFAOYSA-N
MW300.53 g/mol
LogP5.98
Rot. Bonds11

About 2-methyl-1,10-bis[(2-methylpropan-2-yl)oxy]decane

2-methyl-1,10-bis[(2-methylpropan-2-yl)oxy]decane (PubChem CID 19888732) has the molecular formula C19H40O2 and a molecular weight of 300.53 g/mol. Its IUPAC name is 2-methyl-1,10-bis[(2-methylpropan-2-yl)oxy]decane.

Molecular Properties

Compound Name2-methyl-1,10-bis[(2-methylpropan-2-yl)oxy]decane
PubChem CID19888732
Molecular FormulaC19H40O2
Molecular Weight300.53 g/mol
Exact Mass300.30
IUPAC Name2-methyl-1,10-bis[(2-methylpropan-2-yl)oxy]decane
SMILESCC(CCCCCCCCOC(C)(C)C)COC(C)(C)C
InChIInChI=1S/C19H40O2/c1-17(16-21-19(5,6)7)14-12-10-8-9-11-13-15-20-18(2,3)4/h17H,8-16H2,1-7H3
InChIKeyPDKAKJUZHFIALN-UHFFFAOYSA-N
XLogP5.98
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.53
LogP ≤ 55.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[(2-methylpropan-2-yl)oxy]-8-(2-methylpropoxy)octane
CID 173256840
(3R)-3-methyl-4-[(2-methylpropan-2-yl)oxy]butan-1-ol
CID 86735110
(2R)-1-methoxy-2-methyl-3-[(2-methylpropan-2-yl)oxy]propane
CID 90381386
1-[(2-methylpropan-2-yl)oxy]-4-(2-methylpropoxy)butane
CID 139316790
5-methyl-1-[2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-yl]oxyheptane
CID 90783293
9-[(2-methylpropan-2-yl)oxy]nonane-1-thiol
CID 105344392
1,11-dimethoxy-2-methylundecane
CID 118982395
(2R)-2,4-dimethyl-1-[(2-methylpropan-2-yl)oxy]pentane
CID 174384089
1-bromo-2-methyl-3-[(2-methylpropan-2-yl)oxy]propane
CID 12923290
7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane
CID 22907243
1-[(2-methylpropan-2-yl)oxy]nonan-2-ol
CID 105084981
10-[2,6-dimethyl-8-[(2-methylpropan-2-yl)oxy]octan-2-yl]oxy-2,6-dimethyldec-1-ene
CID 162304034

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1,10-bis[(2-methylpropan-2-yl)oxy]decane?
The IUPAC name of 2-methyl-1,10-bis[(2-methylpropan-2-yl)oxy]decane (CID 19888732) is 2-methyl-1,10-bis[(2-methylpropan-2-yl)oxy]decane.
What is the SMILES notation for 2-methyl-1,10-bis[(2-methylpropan-2-yl)oxy]decane?
The canonical SMILES for 2-methyl-1,10-bis[(2-methylpropan-2-yl)oxy]decane is CC(CCCCCCCCOC(C)(C)C)COC(C)(C)C.
What is the InChIKey of 2-methyl-1,10-bis[(2-methylpropan-2-yl)oxy]decane?
The InChIKey is PDKAKJUZHFIALN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40O2/c1-17(16-21-19(5,6)7)14-12-10-8-9-11-13-15-20-18(2,3)4/h17H,8-16H2,1-7H3.
What are the key properties of 2-methyl-1,10-bis[(2-methylpropan-2-yl)oxy]decane?
2-methyl-1,10-bis[(2-methylpropan-2-yl)oxy]decane has a molecular weight of 300.53 g/mol, XLogP of 5.98, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1,10-bis[(2-methylpropan-2-yl)oxy]decane is sourced from PubChem (CID 19888732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).