(2,4-dimethylphenyl)-(2-methyloxolan-3-yl)methanol

C14H20O2 — CID 79762886

IUPAC(2,4-dimethylphenyl)-(2-methyloxolan-3-yl)methanol
SMILESCc1ccc(C(O)C2CCOC2C)c(C)c1
InChIInChI=1S/C14H20O2/c1-9-4-5-12(10(2)8-9)14(15)13-6-7-16-11(13)3/h4-5,8,11,13-15H,6-7H2,1-3H3
InChIKeyLIUPACPOZOWMRX-UHFFFAOYSA-N
MW220.31 g/mol
LogP2.76
Rot. Bonds2

About (2,4-dimethylphenyl)-(2-methyloxolan-3-yl)methanol

(2,4-dimethylphenyl)-(2-methyloxolan-3-yl)methanol (PubChem CID 79762886) has the molecular formula C14H20O2 and a molecular weight of 220.31 g/mol. Its IUPAC name is (2,4-dimethylphenyl)-(2-methyloxolan-3-yl)methanol.

Molecular Properties

Compound Name(2,4-dimethylphenyl)-(2-methyloxolan-3-yl)methanol
PubChem CID79762886
Molecular FormulaC14H20O2
Molecular Weight220.31 g/mol
Exact Mass220.15
IUPAC Name(2,4-dimethylphenyl)-(2-methyloxolan-3-yl)methanol
SMILESCc1ccc(C(O)C2CCOC2C)c(C)c1
InChIInChI=1S/C14H20O2/c1-9-4-5-12(10(2)8-9)14(15)13-6-7-16-11(13)3/h4-5,8,11,13-15H,6-7H2,1-3H3
InChIKeyLIUPACPOZOWMRX-UHFFFAOYSA-N
XLogP2.76
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.31
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-ethoxy-5-methylphenyl)-(2-methyloxolan-3-yl)methanol
CID 79762889
(2-fluorophenyl)-(2-methyloxolan-3-yl)methanol
CID 115781704
cycloheptyl-(2,4-dimethylphenyl)methanol
CID 55199424
(2,3-dichlorophenyl)-(2-methyloxolan-3-yl)methanol
CID 115792974
(2,5-dibromothiophen-3-yl)-(2-methyloxolan-3-yl)methanol
CID 79762717
(5-fluoro-2-methoxyphenyl)-(2-methyloxolan-3-yl)methanol
CID 79763340
(4-bromo-2,5-difluorophenyl)-(2-methyloxolan-3-yl)methanol
CID 79763696
3-[1-bromo-2-(2,5-dimethylphenyl)ethyl]-2-methyloxolane
CID 79762752
(2-fluoro-4,5-dimethoxyphenyl)-(2-methyloxolan-3-yl)methanol
CID 79763153
(2-bromo-4,5-dimethoxyphenyl)-(2-methyloxolan-3-yl)methanol
CID 79762979
(2-methyloxolan-3-yl)-(2,4,6-trifluorophenyl)methanol
CID 79763149
(2-methyloxolan-3-yl)-quinolin-8-ylmethanol
CID 115826838

Frequently Asked Questions

What is the IUPAC name of (2,4-dimethylphenyl)-(2-methyloxolan-3-yl)methanol?
The IUPAC name of (2,4-dimethylphenyl)-(2-methyloxolan-3-yl)methanol (CID 79762886) is (2,4-dimethylphenyl)-(2-methyloxolan-3-yl)methanol.
What is the SMILES notation for (2,4-dimethylphenyl)-(2-methyloxolan-3-yl)methanol?
The canonical SMILES for (2,4-dimethylphenyl)-(2-methyloxolan-3-yl)methanol is Cc1ccc(C(O)C2CCOC2C)c(C)c1.
What is the InChIKey of (2,4-dimethylphenyl)-(2-methyloxolan-3-yl)methanol?
The InChIKey is LIUPACPOZOWMRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O2/c1-9-4-5-12(10(2)8-9)14(15)13-6-7-16-11(13)3/h4-5,8,11,13-15H,6-7H2,1-3H3.
What are the key properties of (2,4-dimethylphenyl)-(2-methyloxolan-3-yl)methanol?
(2,4-dimethylphenyl)-(2-methyloxolan-3-yl)methanol has a molecular weight of 220.31 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dimethylphenyl)-(2-methyloxolan-3-yl)methanol is sourced from PubChem (CID 79762886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).