2-methoxy-4-[(2R)-1-methoxypropan-2-yl]oxy-1-methylbenzene

C12H18O3 — CID 70331911

IUPAC2-methoxy-4-[(2R)-1-methoxypropan-2-yl]oxy-1-methylbenzene
SMILESCOC[C@@H](C)Oc1ccc(C)c(OC)c1
InChIInChI=1S/C12H18O3/c1-9-5-6-11(7-12(9)14-4)15-10(2)8-13-3/h5-7,10H,8H2,1-4H3/t10-/m1/s1
InChIKeyLZVMMMASZFBQNK-SNVBAGLBSA-N
MW210.27 g/mol
LogP2.42
Rot. Bonds5

About 2-methoxy-4-[(2R)-1-methoxypropan-2-yl]oxy-1-methylbenzene

2-methoxy-4-[(2R)-1-methoxypropan-2-yl]oxy-1-methylbenzene (PubChem CID 70331911) has the molecular formula C12H18O3 and a molecular weight of 210.27 g/mol. Its IUPAC name is 2-methoxy-4-[(2R)-1-methoxypropan-2-yl]oxy-1-methylbenzene.

Molecular Properties

Compound Name2-methoxy-4-[(2R)-1-methoxypropan-2-yl]oxy-1-methylbenzene
PubChem CID70331911
Molecular FormulaC12H18O3
Molecular Weight210.27 g/mol
Exact Mass210.13
IUPAC Name2-methoxy-4-[(2R)-1-methoxypropan-2-yl]oxy-1-methylbenzene
SMILESCOC[C@@H](C)Oc1ccc(C)c(OC)c1
InChIInChI=1S/C12H18O3/c1-9-5-6-11(7-12(9)14-4)15-10(2)8-13-3/h5-7,10H,8H2,1-4H3/t10-/m1/s1
InChIKeyLZVMMMASZFBQNK-SNVBAGLBSA-N
XLogP2.42
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.27
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-methoxypropan-2-yloxy)-4-methylbenzene
CID 64765827
methane;2-methoxy-1-methyl-4-propan-2-yloxybenzene;1-methyl-4-propan-2-yloxybenzene
CID 159264370
5-(1-methoxypropan-2-yloxy)-3-methyl-1-benzothiophene
CID 166436778
1-[(2R)-1-methoxypropan-2-yl]oxy-2,4-dimethylbenzene
CID 70331927
2-(3,4-dimethylphenoxy)propan-1-amine
CID 17169740
1-methoxypropan-2-yl 4-methoxy-2-methylbenzoate
CID 71987996
1-chloro-3-(1-methoxypropan-2-yloxy)benzene
CID 64765471
2-methoxy-1-(3-methoxy-4-methylphenyl)ethanol
CID 115819121
4-methoxy-2-(3-methoxypropoxy)-1-methylbenzene
CID 59177328
[2-fluoro-4-(1-methoxypropan-2-yloxy)phenyl]boronic acid
CID 65203767
(1S)-1-[2-fluoro-4-(1-methoxypropan-2-yloxy)phenyl]ethanamine
CID 107718696
1-[(2S)-1-methoxypropan-2-yl]oxy-3-[(2-methylphenyl)methoxy]benzene
CID 141165604

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-[(2R)-1-methoxypropan-2-yl]oxy-1-methylbenzene?
The IUPAC name of 2-methoxy-4-[(2R)-1-methoxypropan-2-yl]oxy-1-methylbenzene (CID 70331911) is 2-methoxy-4-[(2R)-1-methoxypropan-2-yl]oxy-1-methylbenzene.
What is the SMILES notation for 2-methoxy-4-[(2R)-1-methoxypropan-2-yl]oxy-1-methylbenzene?
The canonical SMILES for 2-methoxy-4-[(2R)-1-methoxypropan-2-yl]oxy-1-methylbenzene is COC[C@@H](C)Oc1ccc(C)c(OC)c1.
What is the InChIKey of 2-methoxy-4-[(2R)-1-methoxypropan-2-yl]oxy-1-methylbenzene?
The InChIKey is LZVMMMASZFBQNK-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H18O3/c1-9-5-6-11(7-12(9)14-4)15-10(2)8-13-3/h5-7,10H,8H2,1-4H3/t10-/m1/s1.
What are the key properties of 2-methoxy-4-[(2R)-1-methoxypropan-2-yl]oxy-1-methylbenzene?
2-methoxy-4-[(2R)-1-methoxypropan-2-yl]oxy-1-methylbenzene has a molecular weight of 210.27 g/mol, XLogP of 2.42, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-[(2R)-1-methoxypropan-2-yl]oxy-1-methylbenzene is sourced from PubChem (CID 70331911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).