2-(2-ethylhexoxy)-1-(4-ethylphenyl)propan-1-ol

C19H32O2 — CID 63467008

IUPAC2-(2-ethylhexoxy)-1-(4-ethylphenyl)propan-1-ol
SMILESCCCCC(CC)COC(C)C(O)c1ccc(CC)cc1
InChIInChI=1S/C19H32O2/c1-5-8-9-17(7-3)14-21-15(4)19(20)18-12-10-16(6-2)11-13-18/h10-13,15,17,19-20H,5-9,14H2,1-4H3
InChIKeySUARDVUKELHDHX-UHFFFAOYSA-N
MW292.46 g/mol
LogP4.90
Rot. Bonds10

About 2-(2-ethylhexoxy)-1-(4-ethylphenyl)propan-1-ol

2-(2-ethylhexoxy)-1-(4-ethylphenyl)propan-1-ol (PubChem CID 63467008) has the molecular formula C19H32O2 and a molecular weight of 292.46 g/mol. Its IUPAC name is 2-(2-ethylhexoxy)-1-(4-ethylphenyl)propan-1-ol.

Molecular Properties

Compound Name2-(2-ethylhexoxy)-1-(4-ethylphenyl)propan-1-ol
PubChem CID63467008
Molecular FormulaC19H32O2
Molecular Weight292.46 g/mol
Exact Mass292.24
IUPAC Name2-(2-ethylhexoxy)-1-(4-ethylphenyl)propan-1-ol
SMILESCCCCC(CC)COC(C)C(O)c1ccc(CC)cc1
InChIInChI=1S/C19H32O2/c1-5-8-9-17(7-3)14-21-15(4)19(20)18-12-10-16(6-2)11-13-18/h10-13,15,17,19-20H,5-9,14H2,1-4H3
InChIKeySUARDVUKELHDHX-UHFFFAOYSA-N
XLogP4.90
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.46
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1R,2S)-1,2-bis(4-ethylphenyl)ethane-1,2-diol
CID 131850770
2-(2-cyclopropylethoxy)-1-(4-ethylphenyl)propan-1-ol
CID 106203961
1-(4-ethylphenyl)-2-(4,4,4-trifluorobutoxy)propan-1-ol
CID 82789164
2-(2-ethylhexoxy)-1-octoxypropan-1-ol
CID 87255804
bis[(2S)-2-ethylhexyl] furan-2,5-dicarboxylate
CID 137368086
1-(4-bromophenyl)-1-(2-ethylhexoxy)butan-2-amine
CID 63460276
2-amino-1-(4-ethylphenyl)propan-1-ol
CID 43209069
1-[4-(2-ethylhexoxy)-3-fluorophenyl]ethanamine
CID 43128566
3-(difluoromethoxymethyl)heptane
CID 162429038
3-(2-ethylhexoxy)hexane-2,5-diol
CID 123693494
4-O,5-O-diethyl 1-O,2-O-bis(2-ethylhexyl) benzene-1,2,4,5-tetracarboxylate
CID 50905906
[4-[[4,6-bis[4-[2-ethylhexoxy(hydroxy)methyl]anilino]-1,3,5-triazinan-2-yl]amino]phenyl]-(tert-butylamino)methanol
CID 91237880

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylhexoxy)-1-(4-ethylphenyl)propan-1-ol?
The IUPAC name of 2-(2-ethylhexoxy)-1-(4-ethylphenyl)propan-1-ol (CID 63467008) is 2-(2-ethylhexoxy)-1-(4-ethylphenyl)propan-1-ol.
What is the SMILES notation for 2-(2-ethylhexoxy)-1-(4-ethylphenyl)propan-1-ol?
The canonical SMILES for 2-(2-ethylhexoxy)-1-(4-ethylphenyl)propan-1-ol is CCCCC(CC)COC(C)C(O)c1ccc(CC)cc1.
What is the InChIKey of 2-(2-ethylhexoxy)-1-(4-ethylphenyl)propan-1-ol?
The InChIKey is SUARDVUKELHDHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32O2/c1-5-8-9-17(7-3)14-21-15(4)19(20)18-12-10-16(6-2)11-13-18/h10-13,15,17,19-20H,5-9,14H2,1-4H3.
What are the key properties of 2-(2-ethylhexoxy)-1-(4-ethylphenyl)propan-1-ol?
2-(2-ethylhexoxy)-1-(4-ethylphenyl)propan-1-ol has a molecular weight of 292.46 g/mol, XLogP of 4.90, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylhexoxy)-1-(4-ethylphenyl)propan-1-ol is sourced from PubChem (CID 63467008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).