2-[4-(2,3,3-trimethylbutan-2-yl)phenyl]ethanol

C15H24O — CID 175167761

IUPAC2-[4-(2,3,3-trimethylbutan-2-yl)phenyl]ethanol
SMILESCC(C)(C)C(C)(C)c1ccc(CCO)cc1
InChIInChI=1S/C15H24O/c1-14(2,3)15(4,5)13-8-6-12(7-9-13)10-11-16/h6-9,16H,10-11H2,1-5H3
InChIKeyHEIZYLKQDGEVAP-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.55
Rot. Bonds3

About 2-[4-(2,3,3-trimethylbutan-2-yl)phenyl]ethanol

2-[4-(2,3,3-trimethylbutan-2-yl)phenyl]ethanol (PubChem CID 175167761) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is 2-[4-(2,3,3-trimethylbutan-2-yl)phenyl]ethanol.

Molecular Properties

Compound Name2-[4-(2,3,3-trimethylbutan-2-yl)phenyl]ethanol
PubChem CID175167761
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name2-[4-(2,3,3-trimethylbutan-2-yl)phenyl]ethanol
SMILESCC(C)(C)C(C)(C)c1ccc(CCO)cc1
InChIInChI=1S/C15H24O/c1-14(2,3)15(4,5)13-8-6-12(7-9-13)10-11-16/h6-9,16H,10-11H2,1-5H3
InChIKeyHEIZYLKQDGEVAP-UHFFFAOYSA-N
XLogP3.55
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-[4-(2-hydroxyethyl)phenyl]-3-methylbutanoic acid
CID 115112927
3-[4-[2-[4-(3-hydroxypropyl)phenyl]propan-2-yl]phenyl]propan-1-ol
CID 54337384
hydrogen peroxide;2,3,3-trimethylbutan-2-ylbenzene
CID 23026515
2-[4-[4-(2-hydroxyethyl)phenyl]phenyl]propan-2-ylurea
CID 155759569
4-(2-hydroxyethyl)benzoic acid
CID 506062
2-[4-[4-[4-(2-hydroxypropan-2-yl)phenyl]butyl]phenyl]propan-2-ol
CID 129085386
2-[4-[4-(2-hydroxyethyl)-N-[4-(2-hydroxyethyl)phenyl]anilino]phenyl]ethanol
CID 20580135
3-[2-(4-tert-butylphenyl)ethylamino]-3-methylbutan-1-ol
CID 115134207
2-[4-(2,3,3-trimethylbutylamino)phenyl]ethanol
CID 114270501
3-[2-(4-tert-butylphenyl)ethyl-methylamino]propan-1-ol
CID 115217119
5-[4-(2-hydroxyethyl)anilino]pentan-1-ol
CID 83962274
4-(4-tert-butylphenyl)-2-methylbutan-1-ol
CID 64666507

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2,3,3-trimethylbutan-2-yl)phenyl]ethanol?
The IUPAC name of 2-[4-(2,3,3-trimethylbutan-2-yl)phenyl]ethanol (CID 175167761) is 2-[4-(2,3,3-trimethylbutan-2-yl)phenyl]ethanol.
What is the SMILES notation for 2-[4-(2,3,3-trimethylbutan-2-yl)phenyl]ethanol?
The canonical SMILES for 2-[4-(2,3,3-trimethylbutan-2-yl)phenyl]ethanol is CC(C)(C)C(C)(C)c1ccc(CCO)cc1.
What is the InChIKey of 2-[4-(2,3,3-trimethylbutan-2-yl)phenyl]ethanol?
The InChIKey is HEIZYLKQDGEVAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O/c1-14(2,3)15(4,5)13-8-6-12(7-9-13)10-11-16/h6-9,16H,10-11H2,1-5H3.
What are the key properties of 2-[4-(2,3,3-trimethylbutan-2-yl)phenyl]ethanol?
2-[4-(2,3,3-trimethylbutan-2-yl)phenyl]ethanol has a molecular weight of 220.36 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2,3,3-trimethylbutan-2-yl)phenyl]ethanol is sourced from PubChem (CID 175167761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).