[2,6-dimethyl-4-(3-propan-2-ylphenyl)phenyl]methanol

C18H22O — CID 172876842

IUPAC[2,6-dimethyl-4-(3-propan-2-ylphenyl)phenyl]methanol
SMILESCc1cc(-c2cccc(C(C)C)c2)cc(C)c1CO
InChIInChI=1S/C18H22O/c1-12(2)15-6-5-7-16(10-15)17-8-13(3)18(11-19)14(4)9-17/h5-10,12,19H,11H2,1-4H3
InChIKeyXMMPCQGXRRPSTI-UHFFFAOYSA-N
MW254.37 g/mol
LogP4.59
Rot. Bonds3

About [2,6-dimethyl-4-(3-propan-2-ylphenyl)phenyl]methanol

[2,6-dimethyl-4-(3-propan-2-ylphenyl)phenyl]methanol (PubChem CID 172876842) has the molecular formula C18H22O and a molecular weight of 254.37 g/mol. Its IUPAC name is [2,6-dimethyl-4-(3-propan-2-ylphenyl)phenyl]methanol.

Molecular Properties

Compound Name[2,6-dimethyl-4-(3-propan-2-ylphenyl)phenyl]methanol
PubChem CID172876842
Molecular FormulaC18H22O
Molecular Weight254.37 g/mol
Exact Mass254.17
IUPAC Name[2,6-dimethyl-4-(3-propan-2-ylphenyl)phenyl]methanol
SMILESCc1cc(-c2cccc(C(C)C)c2)cc(C)c1CO
InChIInChI=1S/C18H22O/c1-12(2)15-6-5-7-16(10-15)17-8-13(3)18(11-19)14(4)9-17/h5-10,12,19H,11H2,1-4H3
InChIKeyXMMPCQGXRRPSTI-UHFFFAOYSA-N
XLogP4.59
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[2,6-dimethyl-4-(3-propan-2-ylphenyl)phenyl]-N-methylmethanamine
CID 172876657
2-methyl-4-phenyl-1-(3-propan-2-ylphenyl)benzene
CID 163504476
2-fluoro-3-methyl-5-(3-propan-2-ylphenyl)pyridine
CID 67679272
1-phenyl-4-(3-propan-2-ylphenyl)benzene;1-phenyl-4-(4-propan-2-ylphenyl)benzene
CID 160951739
[4-[6-(3-propan-2-ylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]phenyl]methanol
CID 162671984
[3-[6-(3-propan-2-ylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]phenyl]methanol
CID 162658713
2-methyl-5-(3-propan-2-ylphenyl)benzaldehyde
CID 175665650
2-[3-(3-propan-2-ylphenyl)phenyl]propan-2-ol
CID 170591106
(1R)-1-[3-[3-[(1R)-1-hydroxyethyl]phenyl]phenyl]ethanol
CID 15321486
1-methoxy-3-(3-propan-2-ylphenyl)benzene
CID 23110868
2-methyl-6-(3-propan-2-ylphenyl)aniline
CID 172649943
hydrogen peroxide;bis(1-methyl-3-propan-2-ylbenzene)
CID 172708535

Frequently Asked Questions

What is the IUPAC name of [2,6-dimethyl-4-(3-propan-2-ylphenyl)phenyl]methanol?
The IUPAC name of [2,6-dimethyl-4-(3-propan-2-ylphenyl)phenyl]methanol (CID 172876842) is [2,6-dimethyl-4-(3-propan-2-ylphenyl)phenyl]methanol.
What is the SMILES notation for [2,6-dimethyl-4-(3-propan-2-ylphenyl)phenyl]methanol?
The canonical SMILES for [2,6-dimethyl-4-(3-propan-2-ylphenyl)phenyl]methanol is Cc1cc(-c2cccc(C(C)C)c2)cc(C)c1CO.
What is the InChIKey of [2,6-dimethyl-4-(3-propan-2-ylphenyl)phenyl]methanol?
The InChIKey is XMMPCQGXRRPSTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O/c1-12(2)15-6-5-7-16(10-15)17-8-13(3)18(11-19)14(4)9-17/h5-10,12,19H,11H2,1-4H3.
What are the key properties of [2,6-dimethyl-4-(3-propan-2-ylphenyl)phenyl]methanol?
[2,6-dimethyl-4-(3-propan-2-ylphenyl)phenyl]methanol has a molecular weight of 254.37 g/mol, XLogP of 4.59, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2,6-dimethyl-4-(3-propan-2-ylphenyl)phenyl]methanol is sourced from PubChem (CID 172876842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).