1-methoxy-2,3-dimethyl-5-[(2-methylpropan-2-yl)oxy]benzene

C13H20O2 — CID 67518349

IUPAC1-methoxy-2,3-dimethyl-5-[(2-methylpropan-2-yl)oxy]benzene
SMILESCOc1cc(OC(C)(C)C)cc(C)c1C
InChIInChI=1S/C13H20O2/c1-9-7-11(15-13(3,4)5)8-12(14-6)10(9)2/h7-8H,1-6H3
InChIKeyNVPMBDOWQITVLX-UHFFFAOYSA-N
MW208.30 g/mol
LogP3.49
Rot. Bonds2

About 1-methoxy-2,3-dimethyl-5-[(2-methylpropan-2-yl)oxy]benzene

1-methoxy-2,3-dimethyl-5-[(2-methylpropan-2-yl)oxy]benzene (PubChem CID 67518349) has the molecular formula C13H20O2 and a molecular weight of 208.30 g/mol. Its IUPAC name is 1-methoxy-2,3-dimethyl-5-[(2-methylpropan-2-yl)oxy]benzene.

Molecular Properties

Compound Name1-methoxy-2,3-dimethyl-5-[(2-methylpropan-2-yl)oxy]benzene
PubChem CID67518349
Molecular FormulaC13H20O2
Molecular Weight208.30 g/mol
Exact Mass208.15
IUPAC Name1-methoxy-2,3-dimethyl-5-[(2-methylpropan-2-yl)oxy]benzene
SMILESCOc1cc(OC(C)(C)C)cc(C)c1C
InChIInChI=1S/C13H20O2/c1-9-7-11(15-13(3,4)5)8-12(14-6)10(9)2/h7-8H,1-6H3
InChIKeyNVPMBDOWQITVLX-UHFFFAOYSA-N
XLogP3.49
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-methoxy-2-methyl-4-[(2-methylpropan-2-yl)oxy]benzene
CID 58660022
5-tert-butyl-1,3-dimethoxy-2-methylbenzene
CID 59572485
1-fluoro-3,5-dimethoxy-2-methylbenzene
CID 22970635
(3-methoxy-4,5-dimethylphenyl) N-propan-2-ylcarbamate
CID 158053906
1-methyl-3-[(2-methylpropan-2-yl)oxy]naphthalene
CID 90312399
5-methoxy-1-[2-(5-methoxy-2,3-dimethylphenyl)propan-2-yl]-2,3-dimethylbenzene
CID 20693410
4-[2-methoxy-4-[(2-methylpropan-2-yl)oxy]phenyl]-3,5-dimethylpyridazine
CID 118445645
1-fluoro-2-methyl-4-[(2-methylpropan-2-yl)oxy]benzene
CID 123252856
bis[2,4,6-tris[(2-methylpropan-2-yl)oxy]phenyl]silyloxy-bis[2,4,6-tris[(2-methylpropan-2-yl)oxy]phenyl]silane
CID 123400300
2-methoxy-6-[(2-methylpropan-2-yl)oxy]naphthalene
CID 155296690
lithium;(2,6-dimethoxyphenyl)-[2-methyl-4-[(2-methylpropan-2-yl)oxy]phenyl]phosphanylmethanone;hydride
CID 173243510
1-methoxy-3-[(2-methylpropan-2-yl)oxy]-5-(trifluoromethyl)benzene
CID 166607829

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2,3-dimethyl-5-[(2-methylpropan-2-yl)oxy]benzene?
The IUPAC name of 1-methoxy-2,3-dimethyl-5-[(2-methylpropan-2-yl)oxy]benzene (CID 67518349) is 1-methoxy-2,3-dimethyl-5-[(2-methylpropan-2-yl)oxy]benzene.
What is the SMILES notation for 1-methoxy-2,3-dimethyl-5-[(2-methylpropan-2-yl)oxy]benzene?
The canonical SMILES for 1-methoxy-2,3-dimethyl-5-[(2-methylpropan-2-yl)oxy]benzene is COc1cc(OC(C)(C)C)cc(C)c1C.
What is the InChIKey of 1-methoxy-2,3-dimethyl-5-[(2-methylpropan-2-yl)oxy]benzene?
The InChIKey is NVPMBDOWQITVLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O2/c1-9-7-11(15-13(3,4)5)8-12(14-6)10(9)2/h7-8H,1-6H3.
What are the key properties of 1-methoxy-2,3-dimethyl-5-[(2-methylpropan-2-yl)oxy]benzene?
1-methoxy-2,3-dimethyl-5-[(2-methylpropan-2-yl)oxy]benzene has a molecular weight of 208.30 g/mol, XLogP of 3.49, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2,3-dimethyl-5-[(2-methylpropan-2-yl)oxy]benzene is sourced from PubChem (CID 67518349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).