2-ethyl-3,6-dimethyl-4-propan-2-yloxyphenol

C13H20O2 — CID 162375132

IUPAC2-ethyl-3,6-dimethyl-4-propan-2-yloxyphenol
SMILESCCc1c(C)c(OC(C)C)cc(C)c1O
InChIInChI=1S/C13H20O2/c1-6-11-10(5)12(15-8(2)3)7-9(4)13(11)14/h7-8,14H,6H2,1-5H3
InChIKeyQSUATFUGRPFECI-UHFFFAOYSA-N
MW208.30 g/mol
LogP3.36
Rot. Bonds3

About 2-ethyl-3,6-dimethyl-4-propan-2-yloxyphenol

2-ethyl-3,6-dimethyl-4-propan-2-yloxyphenol (PubChem CID 162375132) has the molecular formula C13H20O2 and a molecular weight of 208.30 g/mol. Its IUPAC name is 2-ethyl-3,6-dimethyl-4-propan-2-yloxyphenol.

Molecular Properties

Compound Name2-ethyl-3,6-dimethyl-4-propan-2-yloxyphenol
PubChem CID162375132
Molecular FormulaC13H20O2
Molecular Weight208.30 g/mol
Exact Mass208.15
IUPAC Name2-ethyl-3,6-dimethyl-4-propan-2-yloxyphenol
SMILESCCc1c(C)c(OC(C)C)cc(C)c1O
InChIInChI=1S/C13H20O2/c1-6-11-10(5)12(15-8(2)3)7-9(4)13(11)14/h7-8,14H,6H2,1-5H3
InChIKeyQSUATFUGRPFECI-UHFFFAOYSA-N
XLogP3.36
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-diethyl-4-methoxy-6-methylphenol
CID 162375144
3-ethyl-2-methyl-4-propan-2-yloxyphenol
CID 162375077
2,6-diethyl-3,5-dimethyl-4-propan-2-yloxyphenol
CID 162375100
ethyl 2-(3-chloro-2,4-dimethyl-6-propan-2-yloxyphenyl)acetate
CID 82553188
2,3-dihydroxy-6-methyl-4-propan-2-yloxybenzamide
CID 145120654
2-chloro-1-(2,3,6-trimethyl-4-propan-2-yloxyphenyl)ethanone
CID 82266293
2,3,5,6-tetraethyl-4-propan-2-yloxyphenol
CID 162375098
2-(4-hydroxy-2,3,5-trimethylphenoxy)propanoic acid
CID 4129569
2,5-diethyl-4-propan-2-yloxyphenol
CID 162375189
2,5-di(propan-2-yloxy)benzene-1,4-diol
CID 70497584
1-(3-methyl-4-propan-2-yloxyphenyl)propan-1-one
CID 82051543
2-ethyl-4-methylbenzene-1,3-diol
CID 66591823

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3,6-dimethyl-4-propan-2-yloxyphenol?
The IUPAC name of 2-ethyl-3,6-dimethyl-4-propan-2-yloxyphenol (CID 162375132) is 2-ethyl-3,6-dimethyl-4-propan-2-yloxyphenol.
What is the SMILES notation for 2-ethyl-3,6-dimethyl-4-propan-2-yloxyphenol?
The canonical SMILES for 2-ethyl-3,6-dimethyl-4-propan-2-yloxyphenol is CCc1c(C)c(OC(C)C)cc(C)c1O.
What is the InChIKey of 2-ethyl-3,6-dimethyl-4-propan-2-yloxyphenol?
The InChIKey is QSUATFUGRPFECI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O2/c1-6-11-10(5)12(15-8(2)3)7-9(4)13(11)14/h7-8,14H,6H2,1-5H3.
What are the key properties of 2-ethyl-3,6-dimethyl-4-propan-2-yloxyphenol?
2-ethyl-3,6-dimethyl-4-propan-2-yloxyphenol has a molecular weight of 208.30 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3,6-dimethyl-4-propan-2-yloxyphenol is sourced from PubChem (CID 162375132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).