1-(ethoxymethyl)-2-methyl-4-propan-2-yloxybenzene

C13H20O2 — CID 129189938

IUPAC1-(ethoxymethyl)-2-methyl-4-propan-2-yloxybenzene
SMILESCCOCc1ccc(OC(C)C)cc1C
InChIInChI=1S/C13H20O2/c1-5-14-9-12-6-7-13(8-11(12)4)15-10(2)3/h6-8,10H,5,9H2,1-4H3
InChIKeyFUCBRKWROBOCLY-UHFFFAOYSA-N
MW208.30 g/mol
LogP3.32
Rot. Bonds5

About 1-(ethoxymethyl)-2-methyl-4-propan-2-yloxybenzene

1-(ethoxymethyl)-2-methyl-4-propan-2-yloxybenzene (PubChem CID 129189938) has the molecular formula C13H20O2 and a molecular weight of 208.30 g/mol. Its IUPAC name is 1-(ethoxymethyl)-2-methyl-4-propan-2-yloxybenzene.

Molecular Properties

Compound Name1-(ethoxymethyl)-2-methyl-4-propan-2-yloxybenzene
PubChem CID129189938
Molecular FormulaC13H20O2
Molecular Weight208.30 g/mol
Exact Mass208.15
IUPAC Name1-(ethoxymethyl)-2-methyl-4-propan-2-yloxybenzene
SMILESCCOCc1ccc(OC(C)C)cc1C
InChIInChI=1S/C13H20O2/c1-5-14-9-12-6-7-13(8-11(12)4)15-10(2)3/h6-8,10H,5,9H2,1-4H3
InChIKeyFUCBRKWROBOCLY-UHFFFAOYSA-N
XLogP3.32
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-methyl-4-propan-2-yloxyphenyl)acetic acid
CID 82264574
4-bromo-1-(ethoxymethyl)-2-methylbenzene
CID 117219809
[4-(ethoxymethyl)-3-methylphenyl]-dimethylbismuthane
CID 87969572
triethyl-(2-methyl-4-propan-2-yloxyphenyl)silane
CID 171366290
4-(1-ethoxypropan-2-yloxy)-2-methylaniline
CID 103486534
ethyl 2-(2-hydroxy-5-propan-2-yloxyphenyl)acetate
CID 82553048
1-(2-methyl-4-propan-2-yloxyphenyl)butan-1-amine
CID 82553641
bis(4-ethyl-3-methylphenyl) carbonate
CID 89437335
1-(ethoxymethyl)-2-methyl-4-[4-(trifluoromethyl)phenyl]benzene
CID 143812957
[3-methyl-4-(2-methylpropyl)phenyl] propanoate
CID 151861053
(4-propan-2-yloxyphenyl)-(2,4,6-trimethylphenyl)methanone
CID 43161494
[2,4-di(propan-2-yloxy)phenyl]methanol
CID 12071268

Frequently Asked Questions

What is the IUPAC name of 1-(ethoxymethyl)-2-methyl-4-propan-2-yloxybenzene?
The IUPAC name of 1-(ethoxymethyl)-2-methyl-4-propan-2-yloxybenzene (CID 129189938) is 1-(ethoxymethyl)-2-methyl-4-propan-2-yloxybenzene.
What is the SMILES notation for 1-(ethoxymethyl)-2-methyl-4-propan-2-yloxybenzene?
The canonical SMILES for 1-(ethoxymethyl)-2-methyl-4-propan-2-yloxybenzene is CCOCc1ccc(OC(C)C)cc1C.
What is the InChIKey of 1-(ethoxymethyl)-2-methyl-4-propan-2-yloxybenzene?
The InChIKey is FUCBRKWROBOCLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O2/c1-5-14-9-12-6-7-13(8-11(12)4)15-10(2)3/h6-8,10H,5,9H2,1-4H3.
What are the key properties of 1-(ethoxymethyl)-2-methyl-4-propan-2-yloxybenzene?
1-(ethoxymethyl)-2-methyl-4-propan-2-yloxybenzene has a molecular weight of 208.30 g/mol, XLogP of 3.32, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethoxymethyl)-2-methyl-4-propan-2-yloxybenzene is sourced from PubChem (CID 129189938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).