2-[4-[2-(methoxymethyl)-4-methylphenyl]-3-methylphenyl]ethanol

C18H22O2 — CID 145122544

IUPAC2-[4-[2-(methoxymethyl)-4-methylphenyl]-3-methylphenyl]ethanol
SMILESCOCc1cc(C)ccc1-c1ccc(CCO)cc1C
InChIInChI=1S/C18H22O2/c1-13-4-6-18(16(10-13)12-20-3)17-7-5-15(8-9-19)11-14(17)2/h4-7,10-11,19H,8-9,12H2,1-3H3
InChIKeyDATIEWYCHNMFGV-UHFFFAOYSA-N
MW270.37 g/mol
LogP3.65
Rot. Bonds5

About 2-[4-[2-(methoxymethyl)-4-methylphenyl]-3-methylphenyl]ethanol

2-[4-[2-(methoxymethyl)-4-methylphenyl]-3-methylphenyl]ethanol (PubChem CID 145122544) has the molecular formula C18H22O2 and a molecular weight of 270.37 g/mol. Its IUPAC name is 2-[4-[2-(methoxymethyl)-4-methylphenyl]-3-methylphenyl]ethanol.

Molecular Properties

Compound Name2-[4-[2-(methoxymethyl)-4-methylphenyl]-3-methylphenyl]ethanol
PubChem CID145122544
Molecular FormulaC18H22O2
Molecular Weight270.37 g/mol
Exact Mass270.16
IUPAC Name2-[4-[2-(methoxymethyl)-4-methylphenyl]-3-methylphenyl]ethanol
SMILESCOCc1cc(C)ccc1-c1ccc(CCO)cc1C
InChIInChI=1S/C18H22O2/c1-13-4-6-18(16(10-13)12-20-3)17-7-5-15(8-9-19)11-14(17)2/h4-7,10-11,19H,8-9,12H2,1-3H3
InChIKeyDATIEWYCHNMFGV-UHFFFAOYSA-N
XLogP3.65
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[3-fluoro-4-[2-(methoxymethyl)-4-methylphenyl]phenyl]methanol
CID 145122947
2-[4-[4-[2-(2-methoxyethoxy)-4-methylphenyl]phenyl]-3-methylphenyl]ethanol
CID 145122060
2-[3-bromo-4-(methoxymethyl)phenyl]ethanol
CID 117364056
[4-[2-(methoxymethyl)-4-(4-methylphenyl)phenyl]phenyl]methanol
CID 145122079
ethane;2-(methoxymethyl)-1,4-dimethylbenzene
CID 143876448
butan-2-one;ethane;2-(methoxymethyl)-4-methyl-1-(4-methylphenyl)benzene
CID 142999553
1,4-bis(methoxymethyl)-2-methylbenzene
CID 19879640
[4-(methoxymethyl)-3-methylphenyl]methanamine
CID 88997132
ethene;1-ethyl-2-(methoxymethyl)-4-methylbenzene
CID 143093796
5-(2-hydroxyethyl)-2-methoxyphenol;2-(4-methoxy-3-methylphenyl)ethanol
CID 167594575
3-[3-bromo-4-(methoxymethyl)phenyl]propan-1-ol
CID 117400911
2-[2-(2-fluoro-4-methylphenyl)-5-(2-hydroxyethyl)phenyl]ethyl 2-methylprop-2-enoate
CID 134200385

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-(methoxymethyl)-4-methylphenyl]-3-methylphenyl]ethanol?
The IUPAC name of 2-[4-[2-(methoxymethyl)-4-methylphenyl]-3-methylphenyl]ethanol (CID 145122544) is 2-[4-[2-(methoxymethyl)-4-methylphenyl]-3-methylphenyl]ethanol.
What is the SMILES notation for 2-[4-[2-(methoxymethyl)-4-methylphenyl]-3-methylphenyl]ethanol?
The canonical SMILES for 2-[4-[2-(methoxymethyl)-4-methylphenyl]-3-methylphenyl]ethanol is COCc1cc(C)ccc1-c1ccc(CCO)cc1C.
What is the InChIKey of 2-[4-[2-(methoxymethyl)-4-methylphenyl]-3-methylphenyl]ethanol?
The InChIKey is DATIEWYCHNMFGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O2/c1-13-4-6-18(16(10-13)12-20-3)17-7-5-15(8-9-19)11-14(17)2/h4-7,10-11,19H,8-9,12H2,1-3H3.
What are the key properties of 2-[4-[2-(methoxymethyl)-4-methylphenyl]-3-methylphenyl]ethanol?
2-[4-[2-(methoxymethyl)-4-methylphenyl]-3-methylphenyl]ethanol has a molecular weight of 270.37 g/mol, XLogP of 3.65, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-(methoxymethyl)-4-methylphenyl]-3-methylphenyl]ethanol is sourced from PubChem (CID 145122544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).