2,2-dimethylpropylbenzene;1-methoxy-2,2-dimethylpropane;methoxymethane

C19H36O2 — CID 160968956

IUPAC2,2-dimethylpropylbenzene;1-methoxy-2,2-dimethylpropane;methoxymethane
SMILESCC(C)(C)Cc1ccccc1.COC.COCC(C)(C)C
InChIInChI=1S/C11H16.C6H14O.C2H6O/c1-11(2,3)9-10-7-5-4-6-8-10;1-6(2,3)5-7-4;1-3-2/h4-8H,9H2,1-3H3;5H2,1-4H3;1-2H3
InChIKeySXZSMNOFXDQDMH-UHFFFAOYSA-N
MW296.50 g/mol
LogP5.22
Rot. Bonds2

About 2,2-dimethylpropylbenzene;1-methoxy-2,2-dimethylpropane;methoxymethane

2,2-dimethylpropylbenzene;1-methoxy-2,2-dimethylpropane;methoxymethane (PubChem CID 160968956) has the molecular formula C19H36O2 and a molecular weight of 296.50 g/mol. Its IUPAC name is 2,2-dimethylpropylbenzene;1-methoxy-2,2-dimethylpropane;methoxymethane.

Molecular Properties

Compound Name2,2-dimethylpropylbenzene;1-methoxy-2,2-dimethylpropane;methoxymethane
PubChem CID160968956
Molecular FormulaC19H36O2
Molecular Weight296.50 g/mol
Exact Mass296.27
IUPAC Name2,2-dimethylpropylbenzene;1-methoxy-2,2-dimethylpropane;methoxymethane
SMILESCC(C)(C)Cc1ccccc1.COC.COCC(C)(C)C
InChIInChI=1S/C11H16.C6H14O.C2H6O/c1-11(2,3)9-10-7-5-4-6-8-10;1-6(2,3)5-7-4;1-3-2/h4-8H,9H2,1-3H3;5H2,1-4H3;1-2H3
InChIKeySXZSMNOFXDQDMH-UHFFFAOYSA-N
XLogP5.22
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500296.50
LogP ≤ 55.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dimethylpropylbenzene;methanol
CID 157125736
2,2-dimethylpropane;2,2-dimethylpropylbenzene;2,2,3-trimethylbutane
CID 159235518
(2-methoxy-2-methylpropyl)benzene
CID 3842751
1-(2,2-dimethylpropyl)-4-phenylbenzene
CID 23381564
1-methoxy-2,2-dimethylpropane
CID 160639316
(2,2-dimethyl-1-phenylpropyl)benzene;2,2-dimethylpropylbenzene
CID 158424284
2-benzyl-3-methoxy-2-phenylpropan-1-amine
CID 139652108
[3-methoxy-2-(methoxymethyl)-2-methylpropoxy]methylbenzene
CID 166487361
(2S)-2-[benzyl(propyl)phosphanyl]-1-methoxypropan-2-amine
CID 174273124
tert-butyl 2,2-dimethylpropanoate;2,2-dimethylpropylbenzene;methane
CID 158149766
(1,4-dimethoxy-2,3-dimethyl-3-phenylbutan-2-yl)benzene
CID 131848966
[4-(2,2-dimethylpropyl)phenyl]-phenyldiazene
CID 134551069

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethylpropylbenzene;1-methoxy-2,2-dimethylpropane;methoxymethane?
The IUPAC name of 2,2-dimethylpropylbenzene;1-methoxy-2,2-dimethylpropane;methoxymethane (CID 160968956) is 2,2-dimethylpropylbenzene;1-methoxy-2,2-dimethylpropane;methoxymethane.
What is the SMILES notation for 2,2-dimethylpropylbenzene;1-methoxy-2,2-dimethylpropane;methoxymethane?
The canonical SMILES for 2,2-dimethylpropylbenzene;1-methoxy-2,2-dimethylpropane;methoxymethane is CC(C)(C)Cc1ccccc1.COC.COCC(C)(C)C.
What is the InChIKey of 2,2-dimethylpropylbenzene;1-methoxy-2,2-dimethylpropane;methoxymethane?
The InChIKey is SXZSMNOFXDQDMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16.C6H14O.C2H6O/c1-11(2,3)9-10-7-5-4-6-8-10;1-6(2,3)5-7-4;1-3-2/h4-8H,9H2,1-3H3;5H2,1-4H3;1-2H3.
What are the key properties of 2,2-dimethylpropylbenzene;1-methoxy-2,2-dimethylpropane;methoxymethane?
2,2-dimethylpropylbenzene;1-methoxy-2,2-dimethylpropane;methoxymethane has a molecular weight of 296.50 g/mol, XLogP of 5.22, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethylpropylbenzene;1-methoxy-2,2-dimethylpropane;methoxymethane is sourced from PubChem (CID 160968956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).