2,5-dimethyl-4-[(2-methylpropan-2-yl)oxy]phenol

C12H18O2 — CID 130032537

IUPAC2,5-dimethyl-4-[(2-methylpropan-2-yl)oxy]phenol
SMILESCc1cc(OC(C)(C)C)c(C)cc1O
InChIInChI=1S/C12H18O2/c1-8-7-11(14-12(3,4)5)9(2)6-10(8)13/h6-7,13H,1-5H3
InChIKeyLWRGQDZZCDNEEN-UHFFFAOYSA-N
MW194.27 g/mol
LogP3.19
Rot. Bonds1

About 2,5-dimethyl-4-[(2-methylpropan-2-yl)oxy]phenol

2,5-dimethyl-4-[(2-methylpropan-2-yl)oxy]phenol (PubChem CID 130032537) has the molecular formula C12H18O2 and a molecular weight of 194.27 g/mol. Its IUPAC name is 2,5-dimethyl-4-[(2-methylpropan-2-yl)oxy]phenol.

Molecular Properties

Compound Name2,5-dimethyl-4-[(2-methylpropan-2-yl)oxy]phenol
PubChem CID130032537
Molecular FormulaC12H18O2
Molecular Weight194.27 g/mol
Exact Mass194.13
IUPAC Name2,5-dimethyl-4-[(2-methylpropan-2-yl)oxy]phenol
SMILESCc1cc(OC(C)(C)C)c(C)cc1O
InChIInChI=1S/C12H18O2/c1-8-7-11(14-12(3,4)5)9(2)6-10(8)13/h6-7,13H,1-5H3
InChIKeyLWRGQDZZCDNEEN-UHFFFAOYSA-N
XLogP3.19
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.27
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(4-hydroxy-2,5-dimethylphenoxy)-2,5-dimethylphenol
CID 22041993
4-(4-hydroxyphenoxy)-2,5-dimethylphenol
CID 18696457
tris(2-tert-butyl-4-hydroxy-5-methylphenyl) phosphite
CID 175167608
2,3-diethyl-5-methyl-4-[(2-methylpropan-2-yl)oxy]phenol
CID 162375128
methyl 5-(4-hydroxy-2,5-dimethylphenoxy)-2,2-dimethylpentanoate
CID 86746388
[4-bis(4-hydroxy-2,5-dimethylphenoxy)phosphanyloxy-2,5-dimethylphenyl] (2,5-dimethylphenyl) (4-hydroxy-2,5-dimethylphenyl) phosphite
CID 142908247
4-hydroxy-5-(4-hydroxy-2,5-dimethylphenoxy)-2,2-dimethylpentanoic acid
CID 162345426
5-chloro-4-ethoxy-2-methylphenol
CID 82490779
tert-butyl N-(4-hydroxy-2,5-dimethylphenyl)carbamate
CID 10609921
1-(4-hydroxyphenyl)-3-[5-methyl-2,4-bis[(2-methylpropan-2-yl)oxy]phenyl]prop-2-en-1-one
CID 54522447
4-chloro-5-methoxy-2-methylphenol
CID 21341377
1-(4-hydroxy-2,5-dimethylphenyl)-2,2-dimethylpropan-1-one
CID 81251769

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-4-[(2-methylpropan-2-yl)oxy]phenol?
The IUPAC name of 2,5-dimethyl-4-[(2-methylpropan-2-yl)oxy]phenol (CID 130032537) is 2,5-dimethyl-4-[(2-methylpropan-2-yl)oxy]phenol.
What is the SMILES notation for 2,5-dimethyl-4-[(2-methylpropan-2-yl)oxy]phenol?
The canonical SMILES for 2,5-dimethyl-4-[(2-methylpropan-2-yl)oxy]phenol is Cc1cc(OC(C)(C)C)c(C)cc1O.
What is the InChIKey of 2,5-dimethyl-4-[(2-methylpropan-2-yl)oxy]phenol?
The InChIKey is LWRGQDZZCDNEEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O2/c1-8-7-11(14-12(3,4)5)9(2)6-10(8)13/h6-7,13H,1-5H3.
What are the key properties of 2,5-dimethyl-4-[(2-methylpropan-2-yl)oxy]phenol?
2,5-dimethyl-4-[(2-methylpropan-2-yl)oxy]phenol has a molecular weight of 194.27 g/mol, XLogP of 3.19, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-4-[(2-methylpropan-2-yl)oxy]phenol is sourced from PubChem (CID 130032537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).