1,3-dimethoxy-2,5-dimethylbenzene

C10H14O2 — CID 524839

IUPAC1,3-dimethoxy-2,5-dimethylbenzene
SMILESCOc1cc(C)cc(OC)c1C
InChIInChI=1S/C10H14O2/c1-7-5-9(11-3)8(2)10(6-7)12-4/h5-6H,1-4H3
InChIKeyGIUXLBFXMAOOQJ-UHFFFAOYSA-N
MW166.22 g/mol
LogP2.32
Rot. Bonds2

About 1,3-dimethoxy-2,5-dimethylbenzene

1,3-dimethoxy-2,5-dimethylbenzene (PubChem CID 524839) has the molecular formula C10H14O2 and a molecular weight of 166.22 g/mol. Its IUPAC name is 1,3-dimethoxy-2,5-dimethylbenzene.

Molecular Properties

Compound Name1,3-dimethoxy-2,5-dimethylbenzene
PubChem CID524839
Molecular FormulaC10H14O2
Molecular Weight166.22 g/mol
Exact Mass166.10
IUPAC Name1,3-dimethoxy-2,5-dimethylbenzene
SMILESCOc1cc(C)cc(OC)c1C
InChIInChI=1S/C10H14O2/c1-7-5-9(11-3)8(2)10(6-7)12-4/h5-6H,1-4H3
InChIKeyGIUXLBFXMAOOQJ-UHFFFAOYSA-N
XLogP2.32
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-ethoxy-3-methoxy-2,5-dimethylbenzene
CID 59933516
(3-methoxy-2,5-dimethylphenyl)methanamine
CID 119023643
5-tert-butyl-1,3-dimethoxy-2-methylbenzene
CID 59572485
2-(3-methoxy-2,5-dimethylphenyl)acetic acid
CID 118998759
(2,6-dimethoxy-4-methylphenyl) hypoiodite
CID 163998630
(3,5-dimethoxy-4-methylphenyl)-trimethoxysilane
CID 59566599
5-(disulfanyl)-1,3-dimethoxy-2-methylbenzene
CID 123867594
(2,6-dimethoxy-4-methylphenyl)methanamine
CID 58024962
3,5-dimethoxy-2,6-dimethylphenol
CID 25145990
2,3-dimethoxy-5-methylaniline
CID 14263216
1-(3,5-dimethoxy-4-methylphenyl)ethanone
CID 20697318
triethoxy-[(3-methoxy-2,5-dimethylphenyl)methyl]silane
CID 59566922

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethoxy-2,5-dimethylbenzene?
The IUPAC name of 1,3-dimethoxy-2,5-dimethylbenzene (CID 524839) is 1,3-dimethoxy-2,5-dimethylbenzene.
What is the SMILES notation for 1,3-dimethoxy-2,5-dimethylbenzene?
The canonical SMILES for 1,3-dimethoxy-2,5-dimethylbenzene is COc1cc(C)cc(OC)c1C.
What is the InChIKey of 1,3-dimethoxy-2,5-dimethylbenzene?
The InChIKey is GIUXLBFXMAOOQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O2/c1-7-5-9(11-3)8(2)10(6-7)12-4/h5-6H,1-4H3.
What are the key properties of 1,3-dimethoxy-2,5-dimethylbenzene?
1,3-dimethoxy-2,5-dimethylbenzene has a molecular weight of 166.22 g/mol, XLogP of 2.32, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethoxy-2,5-dimethylbenzene is sourced from PubChem (CID 524839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).