2-[4-(ethoxymethyl)phenyl]propan-2-ol

C12H18O2 — CID 129179722

IUPAC2-[4-(ethoxymethyl)phenyl]propan-2-ol
SMILESCCOCc1ccc(C(C)(C)O)cc1
InChIInChI=1S/C12H18O2/c1-4-14-9-10-5-7-11(8-6-10)12(2,3)13/h5-8,13H,4,9H2,1-3H3
InChIKeyMXLJZJKOPKVYMN-UHFFFAOYSA-N
MW194.27 g/mol
LogP2.45
Rot. Bonds4

About 2-[4-(ethoxymethyl)phenyl]propan-2-ol

2-[4-(ethoxymethyl)phenyl]propan-2-ol (PubChem CID 129179722) has the molecular formula C12H18O2 and a molecular weight of 194.27 g/mol. Its IUPAC name is 2-[4-(ethoxymethyl)phenyl]propan-2-ol.

Molecular Properties

Compound Name2-[4-(ethoxymethyl)phenyl]propan-2-ol
PubChem CID129179722
Molecular FormulaC12H18O2
Molecular Weight194.27 g/mol
Exact Mass194.13
IUPAC Name2-[4-(ethoxymethyl)phenyl]propan-2-ol
SMILESCCOCc1ccc(C(C)(C)O)cc1
InChIInChI=1S/C12H18O2/c1-4-14-9-10-5-7-11(8-6-10)12(2,3)13/h5-8,13H,4,9H2,1-3H3
InChIKeyMXLJZJKOPKVYMN-UHFFFAOYSA-N
XLogP2.45
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.27
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-(ethoxymethyl)phenyl]methoxymethanol
CID 144565304
1-(ethoxymethyl)-4-methylbenzene
CID 12727419
2-[4-[4-[4-(2-hydroxypropan-2-yl)phenyl]butyl]phenyl]propan-2-ol
CID 129085386
[4-[4-(ethoxymethyl)phenyl]phenyl]methanol
CID 123162407
(213C)ethoxymethylbenzene
CID 87947851
CID 169190312
CID 169190312
1-(4-tert-butylphenyl)-3-ethoxy-2-methylpropan-2-ol
CID 113493295
1-[4-(ethoxymethyl)phenyl]propan-2-one
CID 83878087
4-(ethoxymethyl)-N-ethylaniline;molecular hydrogen
CID 145302198
1-[[4-(ethoxymethyl)phenyl]methyl]-2-methyl-3-[[4-(trifluoromethyl)phenyl]methyl]guanidine
CID 111419987
1-ethoxy-4-[(4-ethoxyphenyl)methoxymethyl]benzene
CID 123874930
1-(2-hydroperoxypropan-2-yl)-4-[2-[2-[2-[[4-(2-hydroperoxypropan-2-yl)phenyl]methoxy]ethoxy]ethoxy]ethoxymethyl]benzene
CID 19825390

Frequently Asked Questions

What is the IUPAC name of 2-[4-(ethoxymethyl)phenyl]propan-2-ol?
The IUPAC name of 2-[4-(ethoxymethyl)phenyl]propan-2-ol (CID 129179722) is 2-[4-(ethoxymethyl)phenyl]propan-2-ol.
What is the SMILES notation for 2-[4-(ethoxymethyl)phenyl]propan-2-ol?
The canonical SMILES for 2-[4-(ethoxymethyl)phenyl]propan-2-ol is CCOCc1ccc(C(C)(C)O)cc1.
What is the InChIKey of 2-[4-(ethoxymethyl)phenyl]propan-2-ol?
The InChIKey is MXLJZJKOPKVYMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O2/c1-4-14-9-10-5-7-11(8-6-10)12(2,3)13/h5-8,13H,4,9H2,1-3H3.
What are the key properties of 2-[4-(ethoxymethyl)phenyl]propan-2-ol?
2-[4-(ethoxymethyl)phenyl]propan-2-ol has a molecular weight of 194.27 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(ethoxymethyl)phenyl]propan-2-ol is sourced from PubChem (CID 129179722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).