1,2,3,4-tetramethyl-5-(2-methyl-5-propan-2-ylphenoxy)benzene

C20H26O — CID 71382787

IUPAC1,2,3,4-tetramethyl-5-(2-methyl-5-propan-2-ylphenoxy)benzene
SMILESCc1ccc(C(C)C)cc1Oc1cc(C)c(C)c(C)c1C
InChIInChI=1S/C20H26O/c1-12(2)18-9-8-13(3)19(11-18)21-20-10-14(4)15(5)16(6)17(20)7/h8-12H,1-7H3
InChIKeyMJPZLHSSNGSSJW-UHFFFAOYSA-N
MW282.43 g/mol
LogP6.14
Rot. Bonds3

About 1,2,3,4-tetramethyl-5-(2-methyl-5-propan-2-ylphenoxy)benzene

1,2,3,4-tetramethyl-5-(2-methyl-5-propan-2-ylphenoxy)benzene (PubChem CID 71382787) has the molecular formula C20H26O and a molecular weight of 282.43 g/mol. Its IUPAC name is 1,2,3,4-tetramethyl-5-(2-methyl-5-propan-2-ylphenoxy)benzene.

Molecular Properties

Compound Name1,2,3,4-tetramethyl-5-(2-methyl-5-propan-2-ylphenoxy)benzene
PubChem CID71382787
Molecular FormulaC20H26O
Molecular Weight282.43 g/mol
Exact Mass282.20
IUPAC Name1,2,3,4-tetramethyl-5-(2-methyl-5-propan-2-ylphenoxy)benzene
SMILESCc1ccc(C(C)C)cc1Oc1cc(C)c(C)c(C)c1C
InChIInChI=1S/C20H26O/c1-12(2)18-9-8-13(3)19(11-18)21-20-10-14(4)15(5)16(6)17(20)7/h8-12H,1-7H3
InChIKeyMJPZLHSSNGSSJW-UHFFFAOYSA-N
XLogP6.14
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.43
LogP ≤ 56.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,5-dimethylphenoxy)-2,3,4,5-tetramethylbenzene
CID 71382789
2-(2-ethylbutoxy)-1-methyl-4-propan-2-ylbenzene
CID 82924112
2-methyl-4-(2-methyl-5-propan-2-ylphenoxy)aniline
CID 26190303
2-[5-chloro-2-(chloromethyl)phenoxy]-1-methyl-4-propan-2-ylbenzene
CID 114847049
2-butan-2-yloxy-1-methyl-4-propan-2-ylbenzene
CID 81005711
2,3,5-trichloro-6-(2-methyl-5-propan-2-ylphenoxy)pyridine
CID 102749594
4-chloro-2-(2-methyl-5-propan-2-ylphenoxy)benzaldehyde
CID 114844853
[3-fluoro-4-(2-methyl-5-propan-2-ylphenoxy)phenyl]methanol
CID 63540052
[4-bromo-2-(2-methyl-5-propan-2-ylphenoxy)phenyl]methanamine
CID 63552389
5-amino-2-(2-methyl-5-propan-2-ylphenoxy)benzonitrile
CID 63458751
5-methyl-6-(2-methyl-5-propan-2-ylphenoxy)pyridin-3-amine
CID 62476910
(2-methyl-5-propan-2-ylphenyl) hydrogen carbonate
CID 165362768

Frequently Asked Questions

What is the IUPAC name of 1,2,3,4-tetramethyl-5-(2-methyl-5-propan-2-ylphenoxy)benzene?
The IUPAC name of 1,2,3,4-tetramethyl-5-(2-methyl-5-propan-2-ylphenoxy)benzene (CID 71382787) is 1,2,3,4-tetramethyl-5-(2-methyl-5-propan-2-ylphenoxy)benzene.
What is the SMILES notation for 1,2,3,4-tetramethyl-5-(2-methyl-5-propan-2-ylphenoxy)benzene?
The canonical SMILES for 1,2,3,4-tetramethyl-5-(2-methyl-5-propan-2-ylphenoxy)benzene is Cc1ccc(C(C)C)cc1Oc1cc(C)c(C)c(C)c1C.
What is the InChIKey of 1,2,3,4-tetramethyl-5-(2-methyl-5-propan-2-ylphenoxy)benzene?
The InChIKey is MJPZLHSSNGSSJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26O/c1-12(2)18-9-8-13(3)19(11-18)21-20-10-14(4)15(5)16(6)17(20)7/h8-12H,1-7H3.
What are the key properties of 1,2,3,4-tetramethyl-5-(2-methyl-5-propan-2-ylphenoxy)benzene?
1,2,3,4-tetramethyl-5-(2-methyl-5-propan-2-ylphenoxy)benzene has a molecular weight of 282.43 g/mol, XLogP of 6.14, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4-tetramethyl-5-(2-methyl-5-propan-2-ylphenoxy)benzene is sourced from PubChem (CID 71382787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).